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Publications

Ismael Rodríguez-Espigares, Mariona Torrens-Fontanals, et al.. 2020. GPCRmd uncovers the dynamics of the 3D-GPCRome. Nature methods 17 (8). doi: 10.1038/s41592-020-0884-y. (http://doi.org/10.1038/s41592-020-0884-y)


Receptor Uniprot entry name Uniprot ID Family Class PDB ID State Species Model type Ligand(s) Model name Num. of atoms Membrane composition Accum. sim. time (µs) Software Force field Submitted by
5-hydroxytryptamine receptor 1b 5ht1b_human P28222 5-Hydroxytryptamine receptors A 4IAR.A Inactive Homo sapiens Complex Ergotamine 5-hydroxytryptamine receptor 1B in complex with ergotamine 81056 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
5-hydroxytryptamine receptor 1b 5ht1b_human P28222 5-Hydroxytryptamine receptors A 4IAQ.A Inactive Homo sapiens Apoform 5-hydroxytryptamine receptor 1B 75571 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
5-hydroxytryptamine receptor 1b 5ht1b_human P28222 5-Hydroxytryptamine receptors A 4IAR.A Inactive Homo sapiens Apoform 5-hydroxytryptamine receptor 1B 82857 POPC 1.25 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
5-hydroxytryptamine receptor 2b 5ht2b_human P41595 5-Hydroxytryptamine receptors A 4IB4.A Intermediate Homo sapiens Complex Ergotamine 5-hydroxytryptamine receptor 2B in complex with ergotamine 80994 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
5-hydroxytryptamine receptor 2b 5ht2b_human P41595 5-Hydroxytryptamine receptors A 4IB4.A Intermediate Homo sapiens Apoform 5-hydroxytryptamine receptor 2B 80975 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m1 acm1_human P11229 Acetylcholine receptors (muscarinic) A 5CXV.A Inactive Homo sapiens Complex Tiotropium Muscarinic acetylcholine receptor M1 in complex with Tiotr... 87098 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m1 acm1_human P11229 Acetylcholine receptors (muscarinic) A 5CXV.A Inactive Homo sapiens Apoform Muscarinic acetylcholine receptor M1 87092 POPC 1.40 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m2 acm2_human P08172 Acetylcholine receptors (muscarinic) A 4MQS.A Active Homo sapiens Complex Chembl3121473 Muscarinic acetylcholine receptor M2 in complex with iperoxo 87053 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m2 acm2_human P08172 Acetylcholine receptors (muscarinic) A 3UON.A Inactive Homo sapiens Complex Quinuclidinyl benzilate Muscarinic acetylcholine receptor M2 in complex with QUINU... 79232 POPC 1.35 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m2 acm2_human P08172 Acetylcholine receptors (muscarinic) A 4MQS.A Active Homo sapiens Apoform Muscarinic acetylcholine receptor M2 87046 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m2 acm2_human P08172 Acetylcholine receptors (muscarinic) A 4MQT.A Active Homo sapiens Apoform Muscarinic acetylcholine receptor M2 83956 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m2 acm2_human P08172 Acetylcholine receptors (muscarinic) A 3UON.A Inactive Homo sapiens Apoform Muscarinic acetylcholine receptor M2 79216 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m3 acm3_rat P08483 Acetylcholine receptors (muscarinic) A 4U15.B Inactive Rattus norvegicus Complex Tiotropium Muscarinic acetylcholine receptor M3 in complex with Tiotr... 75909 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m3 acm3_rat P08483 Acetylcholine receptors (muscarinic) A 4U16.B Inactive Rattus norvegicus Complex Paminereg Muscarinic acetylcholine receptor M3 in complex with Pamin... 75787 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m3 acm3_rat P08483 Acetylcholine receptors (muscarinic) A 4U16.B Inactive Rattus norvegicus Apoform Muscarinic acetylcholine receptor M3 75782 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m3 acm3_rat P08483 Acetylcholine receptors (muscarinic) A 4U15.B Inactive Rattus norvegicus Apoform Muscarinic acetylcholine receptor M3 76185 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m4 acm4_human P08173 Acetylcholine receptors (muscarinic) A 5DSG.B Inactive Homo sapiens Complex Tiotropium Muscarinic acetylcholine receptor M4 in complex with Tiotr... 87497 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Muscarinic acetylcholine receptor m4 acm4_human P08173 Acetylcholine receptors (muscarinic) A 5DSG.B Inactive Homo sapiens Apoform Muscarinic acetylcholine receptor M4 87482 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y00.B Inactive Meleagris gallopavo Complex (r)-dobutamine Beta-1 adrenergic receptor in complex with R-dobutamine 86234 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y00.B Inactive Meleagris gallopavo Complex (r)-dobutamine Partially thermostabilized Beta-1 adrenergic receptor in c... 76842 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y02.B Inactive Meleagris gallopavo Complex Carmoterol Beta-1 adrenergic receptor in complex with carmoterol 86857 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y02.B Inactive Meleagris gallopavo Complex Carmoterol Partially thermostabilized Beta-1 adrenergic receptor in c... 76290 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y03.B Inactive Meleagris gallopavo Complex Levisoprenaline Beta-1 adrenergic receptor in complex with levisoprenaline 90471 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y03.B Inactive Meleagris gallopavo Complex Levisoprenaline Partially thermostabilized Beta-1 adrenergic receptor in c... 76306 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y04.B Inactive Meleagris gallopavo Complex Levalbuterol Beta-1 adrenergic receptor in complex with levalbuterol 93756 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y04.B Inactive Meleagris gallopavo Complex Levalbuterol Beta-1 adrenergic receptor in complex with levalbuterol 76085 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2YCW.A Inactive Meleagris gallopavo Complex (s)-carazolol Beta-1 adrenergic receptor complex with carazolol 80491 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 4BVN.A Inactive Meleagris gallopavo Complex Cyanopindolol Partially thermostabilized Beta-1 adrenergic receptor 75113 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 3ZPQ.B Inactive Meleagris gallopavo Complex 4-(1-piperazinyl)-1h-indole Beta-1 adrenergic receptor in complex with 4-(1-Piperaziny... 97689 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 3ZPQ.B Inactive Meleagris gallopavo Complex 4-(1-piperazinyl)-1h-indole Partially thermostabilized Beta-1 adrenergic receptor in c... 81132 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 4AMI.A Inactive Meleagris gallopavo Complex Unii-19kxx4i4yc Partially thermostabilized Beta-1 adrenergic receptor 79173 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 5A8E.A Inactive Meleagris gallopavo Complex 4-[(2s)-3-(tert-butylamino)-2-hydroxypropoxy]-7-methyl-1h-... Beta-1 adrenergic receptor in complex with XTK 89626 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 5A8E.A Inactive Meleagris gallopavo Complex 4-[(2s)-3-(tert-butylamino)-2-hydroxypropoxy]-7-methyl-1h-... Partially thermostabilized Beta-1 adrenergic receptor in c... 80911 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 4AMJ.B Inactive Meleagris gallopavo Complex (s)-carvedilol Beta-1 adrenergic receptor 79278 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 4AMJ.B Inactive Meleagris gallopavo Complex (s)-carvedilol Partially thermostabilized Beta-1 adrenergic receptor in c... 77488 POPC 1.50 ACEMD CPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y03.B Inactive Meleagris gallopavo Apoform Beta-1 adrenergic receptor 90495 POPC 1.35 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y00.B Inactive Meleagris gallopavo Apoform Beta-1 adrenergic receptor 86233 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y00.B Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 76838 POPC 1.40 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y02.B Inactive Meleagris gallopavo Apoform Beta-1 adrenergic receptor 86862 POPC 1.20 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y02.B Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 76289 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y03.B Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 76309 POPC 1.40 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y04.B Inactive Meleagris gallopavo Apoform Beta-1 adrenergic receptor 93783 POPC 1.35 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2Y04.B Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 76120 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2YCW.A Inactive Meleagris gallopavo Apoform Beta-1 adrenergic receptor 80523 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 2YCW.A Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 75879 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 3ZPQ.B Inactive Meleagris gallopavo Apoform Beta-1 adrenergic receptor 97771 POPC 1.10 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 3ZPQ.B Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 81110 POPC 1.30 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 3ZPR.B Inactive Meleagris gallopavo Apoform Beta-1 adrenergic receptor 85662 POPC 1.20 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 3ZPR.B Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 80298 POPC 1.35 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 3ZPR.B Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 80298 POPC 1.35 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 4AMI.A Inactive Meleagris gallopavo Apoform Beta-1 adrenergic receptor 85040 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 4AMI.A Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 79153 POPC 1.35 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 4AMJ.B Inactive Meleagris gallopavo Apoform Beta-1 adrenergic receptor 79278 POPC 1.15 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 4AMJ.B Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 77479 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 4BVN.A Inactive Meleagris gallopavo Apoform Beta-1 adrenergic receptor 85765 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 4BVN.A Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 75112 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 5A8E.A Inactive Meleagris gallopavo Apoform Beta-1 adrenergic receptor 89628 POPC 1.25 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-1 adrenergic receptor adrb1_melga P07700 Adrenoceptors A 5A8E.A Inactive Meleagris gallopavo Apoform Partially thermostabilized Beta-1 adrenergic receptor 80925 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 3NY8.A Inactive Homo sapiens Complex Ici-118551 Beta-2 adrenergic receptor in complex with ICI-118551 79354 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 4LDO.A Active Homo sapiens Complex Iop Beta-2 adrenergic receptor in complex with epinephrine 89367 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 5JQH.A Inactive Homo sapiens Complex (s)-carazolol Beta-2 adrenergic receptor in complex with (S)-carozol 85991 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 3D4S.A Inactive Homo sapiens Complex Aquanil Beta-2 adrenergic receptor in complex with Aquanil 81266 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 3NY9.A Inactive Homo sapiens Complex Chembl1233771 Beta-2 adrenergic receptor in complex with CHEMBL1233771 84034 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 4LDL.A Active Homo sapiens Complex Chembl1160696 Beta-2 adrenergic receptor in complex with CHEMBL1160696 88334 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 4LDE.A Active Homo sapiens Complex Chembl579394 Beta-2 adrenergic receptor in complex with 8-[(1r)-2-{[1,1... 91064 POPC 1.35 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 3NYA.A Inactive Homo sapiens Complex (-)-alprenolol Beta-2 adrenergic receptor in complex with (-)-Alprenolol 74259 POPC 1.20 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 2RH1.A Inactive Homo sapiens Apoform Beta-2 adrenergic receptor 83081 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 3D4S.A Inactive Homo sapiens Apoform Beta-2 adrenergic receptor 81277 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 3NY8.A Inactive Homo sapiens Apoform Beta-2 adrenergic receptor 79348 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 3NY9.A Inactive Homo sapiens Apoform Beta-2 adrenergic receptor 84022 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 3NYA.A Inactive Homo sapiens Apoform Beta-2 adrenergic receptor 74247 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 4QKX.A Active Homo sapiens Apoform Beta-2 adrenergic receptor 89643 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 4LDE.A Active Homo sapiens Apoform Beta-2 adrenergic receptor 91065 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 3PDS.A Inactive Homo sapiens Apoform Beta-2 adrenergic receptor 93416 POPC 1.35 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 4LDL.A Active Homo sapiens Apoform Beta-2 adrenergic receptor 88317 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 4LDO.A Active Homo sapiens Apoform Beta-2 adrenergic receptor 89361 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Beta-2 adrenergic receptor adrb2_human P07550 Adrenoceptors A 5JQH.A Inactive Homo sapiens Apoform Beta-2 adrenergic receptor 85978 POPC 1.35 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
D(3) dopamine receptor drd3_human P35462 Dopamine receptors A 3PBL.A Inactive Homo sapiens Complex Eticlopride D(3) dopamine receptor in complex with Eticlopride 90321 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
D(3) dopamine receptor drd3_human P35462 Dopamine receptors A 3PBL.A Inactive Homo sapiens Apoform D(3) dopamine receptor 90326 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Histamine h1 receptor hrh1_human P35367 Histamine receptors A 3RZE.A Inactive Homo sapiens Complex E-doxepin Histamine H1 receptor in complex with doxepin 61250 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Histamine h1 receptor hrh1_human P35367 Histamine receptors A 3RZE.A Inactive Homo sapiens Complex Z-doxepin Histamine H1 receptor in complex with Z-doxepin 61250 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Histamine h1 receptor hrh1_human P35367 Histamine receptors A 3RZE.A Inactive Homo sapiens Apoform Histamine H1 receptor 61233 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Type-1 angiotensin ii receptor agtr1_human P30556 Angiotensin receptors A 4ZUD.A Inactive Homo sapiens Complex Olmesartan Type-1 angiotensin II receptor with olmesartan 72226 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Type-1 angiotensin ii receptor agtr1_human P30556 Angiotensin receptors A 4ZUD.A Inactive Homo sapiens Complex Olmesartan Type-1 angiotensin II receptor 72226 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Type-1 angiotensin ii receptor agtr1_human P30556 Angiotensin receptors A 4ZUD.A Inactive Homo sapiens Complex Olmesartan Type-1 angiotensin II receptor in complex with olmesartan 72232 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Type-1 angiotensin ii receptor agtr1_human P30556 Angiotensin receptors A 4YAY.A Inactive Homo sapiens Apoform Type-1 angiotensin II receptor 76991 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Type-1 angiotensin ii receptor agtr1_human P30556 Angiotensin receptors A 4ZUD.A Inactive Homo sapiens Apoform Type-1 angiotensin II receptor 72199 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Endothelin b receptor ednrb_human P24530 Endothelin receptors A 5GLH Inactive Homo sapiens Complex Endothelin B receptor in complex with Endothelin-1 71427 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Endothelin b receptor ednrb_human P24530 Endothelin receptors A 5GLH.A Inactive Homo sapiens Apoform Endothelin B receptor 71247 POPC 1.40 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Neurotensin receptor type 1 ntr1_rat P20789 Neurotensin receptors A 4GRV Active Rattus norvegicus Complex Neurotensin receptor type 1 in complex with neurotensin 79718 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Neurotensin receptor type 1 ntr1_rat P20789 Neurotensin receptors A 4XEE Active Rattus norvegicus Complex Neurotensin receptor type 1 in complex with Neurotensin 72301 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Neurotensin receptor type 1 ntr1_rat P20789 Neurotensin receptors A 4GRV.A Active Rattus norvegicus Apoform Neurotensin receptor type 1 79668 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Neurotensin receptor type 1 ntr1_rat P20789 Neurotensin receptors A 4XEE.A Active Rattus norvegicus Apoform Neurotensin receptor type 1 72209 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Delta-type opioid receptor oprd_human P41143 Opioid receptors A 4N6H.A Inactive Homo sapiens Complex Naltrindole Delta-type opioid receptor in complex with Naltrindole 64043 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Delta-type opioid receptor oprd_human P41143 Opioid receptors A 4N6H.A Inactive Homo sapiens Apoform Delta-type opioid receptor 64015 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Delta-type opioid receptor oprd_human P41143 Opioid receptors A 4RWD.A Inactive Homo sapiens Apoform Delta-type opioid receptor 68040 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Kappa-type opioid receptor oprk_human P41145 Opioid receptors A 4DJH.A Inactive Homo sapiens Complex Jdtic Kappa-type opioid receptor in complex with JDTic 70767 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Kappa-type opioid receptor oprk_human P41145 Opioid receptors A 4DJH.A Inactive Homo sapiens Apoform Kappa-type opioid receptor 70739 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Mu-type opioid receptor oprm_mouse P42866 Opioid receptors A 5C1M.A Active Mus musculus Complex Chembl321570 Mu-type opioid receptor in complex with BU72 70461 POPC 1.25 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Mu-type opioid receptor oprm_mouse P42866 Opioid receptors A 4DKL.A Inactive Mus musculus Apoform Mu-type opioid receptor 73528 POPC 1.35 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Mu-type opioid receptor oprm_mouse P42866 Opioid receptors A 5C1M.A Active Mus musculus Apoform Mu-type opioid receptor 70430 POPC 1.10 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Nociceptin receptor oprx_human P41146 Opioid receptors A 4EA3.A Inactive Homo sapiens Complex Chembl201945 Nociceptin receptor in complex with 1-benzyl-N-[3-(1'H,3H-... 67103 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Nociceptin receptor oprx_human P41146 Opioid receptors A 4EA3.A Inactive Homo sapiens Apoform Nociceptin receptor 67078 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Nociceptin receptor oprx_human P41146 Opioid receptors A 5DHH.A Inactive Homo sapiens Apoform Nociceptin receptor 62143 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Nociceptin receptor oprx_human P41146 Opioid receptors A 5DHG.A Inactive Homo sapiens Apoform Nociceptin receptor 65059 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Orexin receptor type 1 ox1r_human O43613 Orexin receptors A 4ZJC.A Inactive Homo sapiens Complex Sb-674042 Orexin receptor type 1 in complex with sb-674042 85801 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Orexin receptor type 1 ox1r_human O43613 Orexin receptors A 4ZJ8.A Inactive Homo sapiens Complex Suvorexant Orexin receptor type 1 in complex with suvorexant 87043 POPC 1.40 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Orexin receptor type 1 ox1r_human O43613 Orexin receptors A 4ZJ8.A Inactive Homo sapiens Apoform Orexin receptor type 1 87031 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Orexin receptor type 2 ox2r_human O43614 Orexin receptors A 4S0V.A Inactive Homo sapiens Complex Suvorexant Orexin receptor type 2 in complex with Suvorexant 86270 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Orexin receptor type 2 ox2r_human O43614 Orexin receptors A 4S0V.A Inactive Homo sapiens Apoform Orexin receptor type 2 86259 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Proteinase-activated receptor 1 par1_human P25116 Proteinase-activated receptors A 3VW7.A Intermediate Homo sapiens Complex Vorapaxar Proteinase-activated receptor 1 64840 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Proteinase-activated receptor 1 par1_human P25116 Proteinase-activated receptors A 3VW7.A Intermediate Homo sapiens Complex Vorapaxar Proteinase-activated receptor 1 in complex with Vorapaxar 64843 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Proteinase-activated receptor 1 par1_human P25116 Proteinase-activated receptors A 3VW7.A Intermediate Homo sapiens Apoform Proteinase-activated receptor 1 64823 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
C-c chemokine receptor type 5 ccr5_human P51681 Chemokine receptors A 4MBS.A Inactive Homo sapiens Complex Maravirocum C-C chemokine receptor type 5 in complex with maravirocum 67039 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
C-c chemokine receptor type 5 ccr5_human P51681 Chemokine receptors A 4MBS.A Inactive Homo sapiens Complex Maravirocum C-C chemokine receptor type 5 in complex with maravirocum 67047 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
C-c chemokine receptor type 5 ccr5_human P51681 Chemokine receptors A 4MBS.A Inactive Homo sapiens Apoform C-C chemokine receptor type 5 67008 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
C-x-c chemokine receptor type 4 cxcr4_human P61073 Chemokine receptors A 3ODU.A Inactive Homo sapiens Complex It1t C-X-C chemokine receptor type 4 in complex with 1t 68317 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
C-x-c chemokine receptor type 4 cxcr4_human P61073 Chemokine receptors A 3ODU.A Inactive Homo sapiens Complex It1t C-X-C chemokine receptor type 4 in complex with IT1t 68347 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb GPCRmd community Report
C-x-c chemokine receptor type 4 cxcr4_human P61073 Chemokine receptors A 4RWS Inactive Homo sapiens Complex C-X-C chemokine receptor type 4 in complex with vMIP-II W5... 98076 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
C-x-c chemokine receptor type 4 cxcr4_human P61073 Chemokine receptors A 4RWS Inactive Homo sapiens Complex C-X-C chemokine receptor type 4 in complex with vMIP-II W5... 98073 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
C-x-c chemokine receptor type 4 cxcr4_human P61073 Chemokine receptors A 3ODU.A Inactive Homo sapiens Apoform C-X-C chemokine receptor type 4 68282 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
C-x-c chemokine receptor type 4 cxcr4_human P61073 Chemokine receptors A 3OE0.A Inactive Homo sapiens Apoform C-X-C chemokine receptor type 4 68927 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
C-x-c chemokine receptor type 4 cxcr4_human P61073 Chemokine receptors A 4RWS.A Inactive Homo sapiens Apoform C-X-C chemokine receptor type 4 80392 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Free fatty acid receptor 1 ffar1_human O14842 Free fatty acid receptors A 4PHU.A Intermediate Homo sapiens Complex Tak-875 Free fatty acid receptor 1 in complex with TAK-875 64998 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Free fatty acid receptor 1 ffar1_human O14842 Free fatty acid receptors A 4PHU.A Intermediate Homo sapiens Apoform Free fatty acid receptor 1 65033 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Lysophosphatidic acid receptor 1 lpar1_human Q92633 Lysophospholipid (LPA) receptors A 4Z34.A Inactive Homo sapiens Complex Ono9780307 Lysophosphatidic acid receptor 1 in complex with ono9780307 81088 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Lysophosphatidic acid receptor 1 lpar1_human Q92633 Lysophospholipid (LPA) receptors A 4Z36.A Inactive Homo sapiens Complex Ono-3080573 Lysophosphatidic acid receptor 1 in complex withi ono-308... 75727 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Lysophosphatidic acid receptor 1 lpar1_human Q92633 Lysophospholipid (LPA) receptors A 4Z34.A Inactive Homo sapiens Apoform Lysophosphatidic acid receptor 1 81072 POPC 1.15 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Lysophosphatidic acid receptor 1 lpar1_human Q92633 Lysophospholipid (LPA) receptors A 4Z35.A Inactive Homo sapiens Apoform Lysophosphatidic acid receptor 1 77526 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Sphingosine 1-phosphate receptor 1 s1pr1_human P21453 Lysophospholipid (S1P) receptors A 3V2Y.A Inactive Homo sapiens Complex W146 Sphingosine 1-phosphate receptor 1 in complex with W146 80762 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Sphingosine 1-phosphate receptor 1 s1pr1_human P21453 Lysophospholipid (S1P) receptors A 3V2Y.A Inactive Homo sapiens Apoform Sphingosine 1-phosphate receptor 1 80764 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Cannabinoid receptor 1 cnr1_human P21554 Cannabinoid receptors A 5U09.A Inactive Homo sapiens Complex Taranabant Cannabinoid receptor 1 in complex with taranabant 69095 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Cannabinoid receptor 1 cnr1_human P21554 Cannabinoid receptors A 5U09.A Inactive Homo sapiens Complex Taranabant Cannabinoid receptor 1 in complex with Taranabant 69095 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Cannabinoid receptor 1 cnr1_human P21554 Cannabinoid receptors A 5TGZ.A Inactive Homo sapiens Apoform Cannabinoid receptor 1 77514 POPC 1.40 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Cannabinoid receptor 1 cnr1_human P21554 Cannabinoid receptors A 5U09.A Inactive Homo sapiens Apoform Cannabinoid receptor 1 69092 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a1 aa1r_human P30542 Adenosine receptors A 5UEN.Z Inactive Homo sapiens Apoform Adenosine receptor A1 79638 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a1 aa1r_human P30542 Adenosine receptors A 5UEN.Z Inactive Homo sapiens Apoform Adenosine receptor A1 79638 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 2YDV.A Active Homo sapiens Complex N-ethyl-5'-carboxamido adenosine Adenosine receptor A2a in complex with NECA 88821 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 5G53.A Active Homo sapiens Complex N-ethyl-5'-carboxamido adenosine Adenosine receptor A2a in complex with N-ethyl-5'-carboxam... 98653 POPC 1.10 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 4UHR.A Active Homo sapiens Complex Cgs-21680 Adenosine receptor A2a in complex CGS-21680 85036 POPC 1.20 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 4EIY.A Inactive Homo sapiens Complex Zm241385 Adenosine receptor A2a in complex with ZM241385 79221 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 5IU4.A Inactive Homo sapiens Complex Zm241385 Adenosine receptor A2a in complex with ZM241385 86718 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 2YDO.A Active Homo sapiens Complex Adenosine Adenosine receptor A2a in complex with adenosine 88167 POPC 1.05 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 3REY.A Inactive Homo sapiens Complex Xanthine amine congener Adenosine receptor A2a in complex with xanthine amine cong... 100039 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 3RFM.A Inactive Homo sapiens Complex Caffeine Adenosine receptor A2a in complex with caffeine 92961 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 3UZA.A Inactive Homo sapiens Complex Chembl2024115 Adenosine receptor A2a in complex with 6-(2,6-dimethylpyri... 83957 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 3UZC.A Inactive Homo sapiens Complex Chembl2024114 Adenosine receptor A2a in complex with 4-(3-Amino-5-phenyl... 97100 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 2YDO.A Active Homo sapiens Apoform Adenosine receptor A2a 88172 POPC 1.15 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 2YDV.A Active Homo sapiens Apoform Adenosine receptor A2a 88802 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 3QAK.A Active Homo sapiens Apoform Adenosine receptor A2a 90135 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 3REY.A Inactive Homo sapiens Apoform Adenosine receptor A2a 100015 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 3RFM.A Inactive Homo sapiens Apoform Adenosine receptor A2a 92953 POPC 1.10 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 3UZA.A Inactive Homo sapiens Apoform Adenosine receptor A2a 83916 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 3UZC.A Inactive Homo sapiens Apoform Adenosine receptor A2a 97093 POPC 1.40 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 4EIY.A Inactive Homo sapiens Apoform Adenosine receptor A2a 79215 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 4UHR.A Active Homo sapiens Apoform Adenosine receptor A2a 85022 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 5G53.A Active Homo sapiens Apoform Adenosine receptor A2a 98659 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 5IU4.A Inactive Homo sapiens Apoform Adenosine receptor A2a 86703 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 5IU7.A Inactive Homo sapiens Apoform Adenosine receptor A2a 78332 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 5IU8.A Inactive Homo sapiens Apoform Adenosine receptor A2a 90038 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 5IUA.A Inactive Homo sapiens Apoform Adenosine receptor A2a 86479 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Adenosine receptor a2a aa2ar_human P29274 Adenosine receptors A 5IUB.A Inactive Homo sapiens Apoform Adenosine receptor A2a 85682 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
P2y purinoceptor 1 p2ry1_human P47900 P2Y receptors A 4XNW.A Intermediate Homo sapiens Complex Mrs-2500 P2Y purinoceptor 1 in complex with mrs-2500 63564 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
P2y purinoceptor 1 p2ry1_human P47900 P2Y receptors A 4XNW.A Intermediate Homo sapiens Complex Mrs-2500 P2Y purinoceptor 1 in complex with mrs-2500 63561 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
P2y purinoceptor 1 p2ry1_human P47900 P2Y receptors A 4XNV.A Intermediate Homo sapiens Complex Bptu P2Y purinoceptor 1 in complex with BPTU 68835 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
P2y purinoceptor 1 p2ry1_human P47900 P2Y receptors A 4XNV.A Intermediate Homo sapiens Complex Bptu P2Y purinoceptor 1 in complex with BPTU 68835 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
P2y purinoceptor 1 p2ry1_human P47900 P2Y receptors A 4XNV.A Intermediate Homo sapiens Apoform P2Y purinoceptor 1 68818 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
P2y purinoceptor 1 p2ry1_human P47900 P2Y receptors A 4XNW.A Intermediate Homo sapiens Apoform P2Y purinoceptor 1 63523 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
P2y purinoceptor 12 p2y12_human Q9H244 P2Y receptors A 4PXZ.A Intermediate Homo sapiens Complex Methylthio-adenosine diphosphate P2Y purinoceptor 12 in complex with Methylthio-adenosine d... 65814 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
P2y purinoceptor 12 p2y12_human Q9H244 P2Y receptors A 4PY0.A Intermediate Homo sapiens Complex 2-mesatp P2Y purinoceptor 12 in complex with 2-Mesatp 71284 POPC 3.90 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
P2y purinoceptor 12 p2y12_human Q9H244 P2Y receptors A 4PXZ.A Intermediate Homo sapiens Apoform P2Y purinoceptor 12 65732 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
P2y purinoceptor 12 p2y12_human Q9H244 P2Y receptors A 4PY0.A Intermediate Homo sapiens Apoform P2Y purinoceptor 12 71250 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Rhodopsin opsd_bovin P02699 Opsins A 1U19.A Inactive Bos taurus Apoform Rhodopsin 81138 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Rhodopsin opsd_bovin P02699 Opsins A 3DQB.A Active Bos taurus Apoform Rhodopsin 68456 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Rhodopsin opsd_bovin P02699 Opsins A 3PQR.A Active Bos taurus Apoform Rhodopsin 70593 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
G-protein coupled receptor homolog us28 us28_hcmva P69332 Unclassified A 4XT1.A Active Human cytomegalovirus (strain AD169) Apoform G-protein coupled receptor homolog US28 76461 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Corticotropin-releasing factor receptor 1 crfr1_human P34998 Corticotropin-releasing factor receptors B1 4K5Y.C Inactive Homo sapiens Complex Cp-376395 Corticotropin-releasing factor receptor 1 in complex with ... 76319 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Corticotropin-releasing factor receptor 1 crfr1_human P34998 Corticotropin-releasing factor receptors B1 4K5Y.C Inactive Homo sapiens Apoform Corticotropin-releasing factor receptor 1 76298 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Glucagon receptor glr_human P47871 Glucagon receptor family B1 4L6R.A Inactive Homo sapiens Apoform Glucagon receptor 83794 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Metabotropic glutamate receptor 1 grm1_human Q13255 Metabotropic glutamate receptors C 4OR2.A Inactive Homo sapiens Apoform Metabotropic glutamate receptor 1 64854 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Metabotropic glutamate receptor 5 grm5_human P41594 Metabotropic glutamate receptors C 5CGD.A Inactive Homo sapiens Complex Htl14242 Metabotropic glutamate receptor 5 in complex with HTL14242 65484 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Metabotropic glutamate receptor 5 grm5_human P41594 Metabotropic glutamate receptors C 4OO9.A Inactive Homo sapiens Apoform Metabotropic glutamate receptor 5 69144 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Metabotropic glutamate receptor 5 grm5_human P41594 Metabotropic glutamate receptors C 5CGC.A Inactive Homo sapiens Apoform Metabotropic glutamate receptor 5 67330 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Metabotropic glutamate receptor 5 grm5_human P41594 Metabotropic glutamate receptors C 5CGD.A Inactive Homo sapiens Apoform Metabotropic glutamate receptor 5 65499 POPC 1.50 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Smoothened homolog smo_human Q99835 Frizzled F 5L7I.Z Inactive Homo sapiens Complex Vismodegib Smoothened homolog in complex with Vismodegib 155588 POPC 1.45 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Smoothened homolog smo_human Q99835 Frizzled F 5L7D.Z Inactive Homo sapiens Apoform Smoothened homolog 143599 POPC 1.35 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report
Smoothened homolog smo_human Q99835 Frizzled F 5L7I.Z Inactive Homo sapiens Apoform Smoothened homolog 155591 POPC 1.40 ACEMD GPUGRID CHARMM 36m Feb 2016 GPCRmd community Report

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