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5IUA

Crystal structure of stabilized A2A adenosine receptor A2AR-StaR2-bRIL in complex with compound 12b at 2.2A resolution

Functional Information from GO Data
ChainGOidnamespacecontents
A0001609molecular_functionG protein-coupled adenosine receptor activity
A0001973biological_processG protein-coupled adenosine receptor signaling pathway
A0004930molecular_functionG protein-coupled receptor activity
A0005506molecular_functioniron ion binding
A0007186biological_processG protein-coupled receptor signaling pathway
A0009055molecular_functionelectron transfer activity
A0016020cellular_componentmembrane
A0020037molecular_functionheme binding
A0022900biological_processelectron transport chain
A0042597cellular_componentperiplasmic space
A0046872molecular_functionmetal ion binding
Functional Information from PDB Data
site_idAC1
Number of Residues5
Detailsbinding site for residue NA A 2400
ChainResidue
AASP52
ASER91
AHOH2522
AHOH2577
AHOH2593

site_idAC2
Number of Residues15
Detailsbinding site for residue 6DX A 2401
ChainResidue
ATRP246
ALEU249
AHIS250
AASN253
AHIS264
AALA265
ALEU267
AMET270
AILE274
AHOH2567
AHOH2585
ALEU85
APHE168
AGLU169
AMET177

site_idAC3
Number of Residues9
Detailsbinding site for residue CLR A 2402
ChainResidue
AHIS75
AGLY76
APHE79
APHE133
ACLR2403
AOLA2417
AOLA2418
AOLB2423
AOLB2428

site_idAC4
Number of Residues7
Detailsbinding site for residue CLR A 2403
ChainResidue
AALA72
AALA73
AGLY76
AILE80
ACLR2402
ACLR2405
AOLB2424

site_idAC5
Number of Residues4
Detailsbinding site for residue CLR A 2404
ChainResidue
APRO248
ACYS262
ASER263
AOLA2411

site_idAC6
Number of Residues9
Detailsbinding site for residue CLR A 2405
ChainResidue
ALEU187
APHE255
APHE258
ACLR2403
AOLA2422
AOLB2424
AOLB2426
AOLB2427
AHOH2507

site_idAC7
Number of Residues3
Detailsbinding site for residue OLA A 2406
ChainResidue
ATHR65
APHE70
AOLB2427

site_idAC8
Number of Residues1
Detailsbinding site for residue OLA A 2407
ChainResidue
APRO266

site_idAC9
Number of Residues4
Detailsbinding site for residue OLA A 2408
ChainResidue
APHE44
AALA97
AVAL116
AHOH2538

site_idAD1
Number of Residues6
Detailsbinding site for residue OLA A 2409
ChainResidue
AGLY5
ASER6
ALEU267
ATYR271
AVAL275
AOLA2419

site_idAD2
Number of Residues5
Detailsbinding site for residue OLA A 2410
ChainResidue
ALEU96
AILE127
AILE135
AOLA2414
AOLB2430

site_idAD3
Number of Residues1
Detailsbinding site for residue OLA A 2411
ChainResidue
ACLR2404

site_idAD4
Number of Residues5
Detailsbinding site for residue OLA A 2412
ChainResidue
ALEU19
ALEU22
ATRP29
APHE286
AHOH2560

site_idAD5
Number of Residues1
Detailsbinding site for residue OLA A 2413
ChainResidue
AOLA2419

site_idAD6
Number of Residues4
Detailsbinding site for residue OLA A 2414
ChainResidue
AARG120
AGLY123
AVAL130
AOLA2410

site_idAD7
Number of Residues4
Detailsbinding site for residue OLA A 2415
ChainResidue
AVAL25
ATRP32
ALYS233
AOLB2429

site_idAD8
Number of Residues3
Detailsbinding site for residue OLA A 2416
ChainResidue
AILE3
ASER7
AOLB2425

site_idAD9
Number of Residues4
Detailsbinding site for residue OLA A 2417
ChainResidue
APHE133
ACLR2402
AOLA2418
AOLB2428

site_idAE1
Number of Residues5
Detailsbinding site for residue OLA A 2418
ChainResidue
AHIS75
AMET140
ACLR2402
AOLA2417
AOLB2430

site_idAE2
Number of Residues5
Detailsbinding site for residue OLA A 2419
ChainResidue
AOLA2413
ATHR279
APHE286
ATYR290
AOLA2409

site_idAE3
Number of Residues1
Detailsbinding site for residue OLA A 2421
ChainResidue
ALEU244

site_idAE4
Number of Residues3
Detailsbinding site for residue OLA A 2422
ChainResidue
AALA236
AALA239
ACLR2405

site_idAE5
Number of Residues7
Detailsbinding site for residue OLB A 2423
ChainResidue
ATYR179
APHE258
ACLR2402
AOLB2424
AOLB2430
AHOH2502
AHOH2518

site_idAE6
Number of Residues6
Detailsbinding site for residue OLB A 2424
ChainResidue
ALEU187
APHE258
ACLR2403
ACLR2405
AOLB2423
AHOH2507

site_idAE7
Number of Residues5
Detailsbinding site for residue OLB A 2425
ChainResidue
ASER6
ASER67
ATHR68
AOLA2416
AHOH2579

site_idAE8
Number of Residues4
Detailsbinding site for residue OLB A 2426
ChainResidue
APHE255
ACYS262
ACLR2405
AOLB2427

site_idAE9
Number of Residues9
Detailsbinding site for residue OLB A 2427
ChainResidue
APRO61
ATHR65
APHE70
ACYS71
AGLN163
AASP261
ACLR2405
AOLA2406
AOLB2426

site_idAF1
Number of Residues7
Detailsbinding site for residue OLB A 2428
ChainResidue
ATYR43
AGLY118
AALA122
ATRP129
ACLR2402
AOLA2417
AOLB2429

site_idAF2
Number of Residues6
Detailsbinding site for residue OLB A 2429
ChainResidue
ACYS28
ATRP32
ATYR43
AARG205
AOLA2415
AOLB2428

site_idAF3
Number of Residues9
Detailsbinding site for residue OLB A 2430
ChainResidue
AHIS75
AMET140
ALEU141
AGLY142
AASN175
ATYR179
AOLA2410
AOLA2418
AOLB2423

Functional Information from PROSITE/UniProt
site_idPS00237
Number of Residues17
DetailsG_PROTEIN_RECEP_F1_1 G-protein coupled receptors family 1 signature. SSIfSLLAIAIDRYIaI
ChainResidueDetails
ASER90-ILE106

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues24
DetailsTRANSMEM: Helical; Name=1
ChainResidueDetails
AVAL8-TRP32

site_idSWS_FT_FI2
Number of Residues28
DetailsTOPO_DOM: Cytoplasmic => ECO:0000269|PubMed:18832607
ChainResidueDetails
ALEU33-ASN42
AASP101-ARG120

site_idSWS_FT_FI3
Number of Residues23
DetailsTRANSMEM: Helical; Name=2
ChainResidueDetails
ATYR43-ILE66

site_idSWS_FT_FI4
Number of Residues46
DetailsTOPO_DOM: Extracellular => ECO:0000269|PubMed:18832607
ChainResidueDetails
ASER67-CYS77
AASN144-PRO173
ACYS259-PRO266

site_idSWS_FT_FI5
Number of Residues22
DetailsTRANSMEM: Helical; Name=3
ChainResidueDetails
ALEU78-ILE100

site_idSWS_FT_FI6
Number of Residues22
DetailsTRANSMEM: Helical; Name=4
ChainResidueDetails
AALA121-TRP143

site_idSWS_FT_FI7
Number of Residues24
DetailsTRANSMEM: Helical; Name=5
ChainResidueDetails
AMET174-LEU198

site_idSWS_FT_FI8
Number of Residues23
DetailsTRANSMEM: Helical; Name=6
ChainResidueDetails
AALA235-PHE258

site_idSWS_FT_FI9
Number of Residues23
DetailsTRANSMEM: Helical; Name=7
ChainResidueDetails
ALEU267-TYR290

site_idSWS_FT_FI10
Number of Residues4
DetailsBINDING: BINDING => ECO:0000269|PubMed:21593763, ECO:0007744|PDB:2YDO
ChainResidueDetails
AGLU169
AASN253
AALA277
AHIS278

site_idSWS_FT_FI11
Number of Residues1
DetailsCARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000255
ChainResidueDetails
AALA154

site_idSWS_FT_FI12
Number of Residues2
DetailsBINDING: axial binding residue
ChainResidueDetails
ATRP1007
AILE1102

219140

PDB entries from 2024-05-01

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