Summary Structural details Experimental details Functional details Sequence Neighbor History Downloads

5MZP

Crystal structure of stabilized A2A adenosine receptor A2AR-StaR2-bRIL in complex with caffeine at 2.1A resolution

Functional Information from GO Data

Chain	GOid	namespace	contents
A	0001609	molecular_function	G protein-coupled adenosine receptor activity
A	0001973	biological_process	G protein-coupled adenosine receptor signaling pathway
A	0004930	molecular_function	G protein-coupled receptor activity
A	0005506	molecular_function	iron ion binding
A	0007186	biological_process	G protein-coupled receptor signaling pathway
A	0009055	molecular_function	electron transfer activity
A	0016020	cellular_component	membrane
A	0020037	molecular_function	heme binding
A	0022900	biological_process	electron transport chain
A	0042597	cellular_component	periplasmic space
A	0046872	molecular_function	metal ion binding

Functional Information from PDB Data

site_id	AC1
Number of Residues	5
Details	binding site for residue NA A 2400

Chain	Residue
A	ASP52
A	SER91
A	HOH2507
A	HOH2546
A	HOH2573

site_id	AC2
Number of Residues	12
Details	binding site for residue CFF A 2401

Chain	Residue
A	LEU249
A	ASN253
A	MET270
A	ILE274
A	HOH2527
A	HOH2559
A	HOH2589
A	HOH2668
A	VAL84
A	PHE168
A	GLU169
A	MET177

site_id	AC3
Number of Residues	7
Details	binding site for residue CLR A 2402

Chain	Residue
A	ALA73
A	HIS75
A	GLY76
A	OLA2420
A	OLA2421
A	OLC2424
A	HOH2558

site_id	AC4
Number of Residues	8
Details	binding site for residue CLR A 2403

Chain	Residue
A	ALA72
A	ALA73
A	GLY76
A	ILE80
A	CLR2405
A	OLC2424
A	OLC2427
A	HOH2544

site_id	AC5
Number of Residues	7
Details	binding site for residue CLR A 2404

Chain	Residue
A	LEU247
A	PRO248
A	CYS262
A	SER263
A	OLA2412
A	OLC2426
A	HOH2570

site_id	AC6
Number of Residues	7
Details	binding site for residue CLR A 2405

Chain	Residue
A	PHE255
A	PHE258
A	CLR2403
A	OLA2419
A	OLC2424
A	OLC2427
A	HOH2569

site_id	AC7
Number of Residues	4
Details	binding site for residue OLA A 2406

Chain	Residue
A	PHE44
A	ALA97
A	ILE124
A	HOH2584

site_id	AC8
Number of Residues	3
Details	binding site for residue OLA A 2407

Chain	Residue
A	OLA2417
A	OLA2417
A	HOH2515

site_id	AC9
Number of Residues	5
Details	binding site for residue OLA A 2408

Chain	Residue
A	ILE127
A	PRO189
A	LEU192
A	ARG199
A	OLA2415

site_id	AD1
Number of Residues	5
Details	binding site for residue OLA A 2410

Chain	Residue
A	SER7
A	LEU19
A	GLY23
A	LEU26
A	PHE286

site_id	AD2
Number of Residues	1
Details	binding site for residue OLA A 2412

Chain	Residue
A	CLR2404

site_id	AD3
Number of Residues	3
Details	binding site for residue OLA A 2413

Chain	Residue
A	SER7
A	THR11
A	LEU14

site_id	AD4
Number of Residues	6
Details	binding site for residue OLA A 2414

Chain	Residue
A	VAL25
A	TRP29
A	TRP32
A	PHE201
A	LYS233
A	OLA2419

site_id	AD5
Number of Residues	4
Details	binding site for residue OLA A 2415

Chain	Residue
A	ARG120
A	GLY123
A	VAL130
A	OLA2408

site_id	AD6
Number of Residues	2
Details	binding site for residue OLA A 2416

Chain	Residue
A	ILE287
A	OLA2417

site_id	AD7
Number of Residues	7
Details	binding site for residue OLA A 2417

Chain	Residue
A	VAL12
A	LEU19
A	THR279
A	PHE286
A	OLA2407
A	OLA2407
A	OLA2416

site_id	AD8
Number of Residues	1
Details	binding site for residue OLA A 2418

Chain	Residue
A	GLY240

site_id	AD9
Number of Residues	5
Details	binding site for residue OLA A 2419

Chain	Residue
A	LEU194
A	PHE201
A	ALA239
A	CLR2405
A	OLA2414

site_id	AE1
Number of Residues	5
Details	binding site for residue OLA A 2420

Chain	Residue
A	HIS75
A	MET140
A	CLR2402
A	OLA2422
A	OLA2423

site_id	AE2
Number of Residues	5
Details	binding site for residue OLA A 2421

Chain	Residue
A	CLR2402
A	OLA2422
A	OLC2424
A	TYR179
A	PHE258

site_id	AE3
Number of Residues	10
Details	binding site for residue OLA A 2422

Chain	Residue
A	HIS75
A	MET140
A	LEU141
A	GLY142
A	ASN144
A	ASN175
A	TYR179
A	OLA2420
A	OLA2421
A	HOH2525

site_id	AE4
Number of Residues	3
Details	binding site for residue OLA A 2423

Chain	Residue
A	PHE133
A	OLA2420
A	OLC2428

site_id	AE5
Number of Residues	5
Details	binding site for residue OLC A 2424

Chain	Residue
A	PHE258
A	CLR2402
A	CLR2403
A	CLR2405
A	OLA2421

site_id	AE6
Number of Residues	3
Details	binding site for residue OLC A 2425

Chain	Residue
A	SER6
A	ILE10
A	HOH2601

site_id	AE7
Number of Residues	9
Details	binding site for residue OLC A 2426

Chain	Residue
A	ASP261
A	CYS262
A	LYS1085
A	CLR2404
A	OLC2427
A	OLC2430
A	HOH2533
A	HOH2570
A	HOH2586

site_id	AE8
Number of Residues	12
Details	binding site for residue OLC A 2427

Chain	Residue
A	VAL57
A	LEU58
A	PRO61
A	THR65
A	PHE70
A	CYS71
A	GLN163
A	CYS259
A	ASP261
A	CLR2403
A	CLR2405
A	OLC2426

site_id	AE9
Number of Residues	6
Details	binding site for residue OLC A 2428

Chain	Residue
A	TYR43
A	SER47
A	GLY118
A	TRP129
A	PHE133
A	OLA2423

site_id	AF1
Number of Residues	5
Details	binding site for residue OLC A 2429

Chain	Residue
A	CYS28
A	TRP32
A	TYR43
A	VAL46
A	ALA50

site_id	AF2
Number of Residues	4
Details	binding site for residue OLC A 2430

Chain	Residue
A	THR65
A	THR68
A	OLC2426
A	HOH2595

site_id	AF3
Number of Residues	12
Details	binding site for residue TAR A 2431

Chain	Residue
A	GLY142
A	GLY142
A	TRP143
A	TRP143
A	ASN144
A	ASN144
A	ASN145
A	ASN145
A	ASN175
A	ASN175
A	HOH2617
A	HOH2617

Functional Information from PROSITE/UniProt

site_id	PS00237
Number of Residues	17
Details	G_PROTEIN_RECEP_F1_1 G-protein coupled receptors family 1 signature. SSIfSLLAIAIDRYIaI

Chain	Residue	Details
A	SER90-ILE106

Functional Information from SwissProt/UniProt

site_id	SWS_FT_FI1
Number of Residues	2
Details	Binding site: {"description":"axial binding residue"}

Chain

Residue

Details

site_id	SWS_FT_FI2
Number of Residues	24
Details	Transmembrane: {"description":"Helical; Name=1"}

Chain

Residue

Details

site_id	SWS_FT_FI3
Number of Residues	28
Details	Topological domain: {"description":"Cytoplasmic","evidences":[{"source":"PubMed","id":"18832607","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI4
Number of Residues	23
Details	Transmembrane: {"description":"Helical; Name=2"}

Chain

Residue

Details

site_id	SWS_FT_FI5
Number of Residues	46
Details	Topological domain: {"description":"Extracellular","evidences":[{"source":"PubMed","id":"18832607","evidenceCode":"ECO:0000269"}]}

Chain

Residue

Details

site_id	SWS_FT_FI6
Number of Residues	22
Details	Transmembrane: {"description":"Helical; Name=3"}

Chain

Residue

Details

site_id	SWS_FT_FI7
Number of Residues	22
Details	Transmembrane: {"description":"Helical; Name=4"}

Chain

Residue

Details

site_id	SWS_FT_FI8
Number of Residues	24
Details	Transmembrane: {"description":"Helical; Name=5"}

Chain

Residue

Details

site_id	SWS_FT_FI9
Number of Residues	23
Details	Transmembrane: {"description":"Helical; Name=6"}

Chain

Residue

Details

site_id	SWS_FT_FI10
Number of Residues	23
Details	Transmembrane: {"description":"Helical; Name=7"}

Chain

Residue

Details

site_id	SWS_FT_FI11
Number of Residues	4
Details	Binding site: {"evidences":[{"source":"PubMed","id":"21593763","evidenceCode":"ECO:0000269"},{"source":"PDB","id":"2YDO","evidenceCode":"ECO:0007744"}]}

Chain

Residue

Details

site_id	SWS_FT_FI12
Number of Residues	1
Details	Glycosylation: {"description":"N-linked (GlcNAc...) asparagine","evidences":[{"evidenceCode":"ECO:0000255"}]}

Chain

Residue

Details

		Sequence (fasta)
		PDBx/mmCIF
		PDBML format (no-atom)
		PDB format (full)
		Validation report (PDF)
		EDMap 2fo-fc (MTZ)