9WEU

D1R-Gs in complexed with SKF81297/LY3154207/BMSA1

This is a non-PDB format compatible entry.

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A (A)	Guanine nucleotide-binding protein G(s) subunit alpha isoforms short	polymer	246	29048.9	1	UniProt (P63092)	Homo sapiens (human)	Adenylate cyclase-stimulating G alpha protein
2	B (B)	Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1	polymer	371	40227.0	1	UniProt (P54311)	Rattus norvegicus (Rat)	Transducin beta chain 1
3	C (G)	Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2	polymer	68	7563.8	1	UniProt (P63212)	Bos taurus (domestic cattle)	G gamma-I
4	D (N)	Nanobody35	polymer	160	17352.5	1		Vicugna pacos
5	E (R)	Beta-2 adrenergic receptor,D(1A) dopamine receptor,Engineered oplophorus-luciferin 2-monooxygenase catalytic subunit	polymer	603	66836.8	1	UniProt (P07550) UniProt (P21728)	Homo sapiens (human)	Beta-2 adrenoreceptor,Beta-2 adrenoceptor,Dopamine D1 receptor
6	F (R)	CHOLESTEROL	non-polymer		386.7	1	Chemie (CLR) PubChem (5997)
7	G (R)	1-[(1~{S},3~{R},6~{R})-6-(1,3-benzodioxol-5-yl)-3-bicyclo[4.1.0]heptanyl]-4-[(2-bromanyl-5-chloranyl-phenyl)methyl]piperazine	non-polymer		503.9	1	Chemie (A1EV3)
8	H (R)	(1R)-6-chloro-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine-7,8-diol	non-polymer		289.8	1	Chemie (SK0) PubChem (12668019)
9	I (R)	2-[2,6-bis(chloranyl)phenyl]-1-[(1S,3R)-3-(hydroxymethyl)-1-methyl-5-(3-methyl-3-oxidanyl-butyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone	non-polymer		450.4	1	Chemie (G4C) PubChem (86290953)
10	J, K, L, M (R)	PALMITIC ACID	non-polymer		256.4	4	Chemie (PLM) PubChem (985)

Sequence modifications

A: 1 - 66 (UniProt: P63092)

PDB	External Database	Details
Met 25	Lys 25	conflict
Asp 49	Gly 49	conflict
Asn 50	Glu 50	conflict
Tyr 63	Leu 63	conflict

A: 67 - 116 (UniProt: P63092)

PDB	External Database	Details
Ala 88	Gly 226	conflict
Asp 111	Ala 249	conflict
Asp 114	Ser 252	conflict

A: 117 - 246 (UniProt: P63092)

PDB	External Database	Details
Asp 124	Leu 272	conflict
Ser 218	Ala 366	conflict
Ala 224	Ile 372	conflict
Ile 227	Val 375	conflict

B: 2 - 340 (UniProt: P54311)

PDB	External Database	Details
Met -4	-	initiating methionine
Gly -3	-	expression tag
Ser -2	-	expression tag
Leu -1	-	expression tag
Leu 0	-	expression tag
Gln 1	-	expression tag
Gly 341	-	expression tag
Ser 342	-	expression tag
Ser 343	-	expression tag
Gly 344	-	expression tag
Gly 345	-	expression tag
Gly 346	-	expression tag
Gly 347	-	expression tag
Ser 348	-	expression tag
Gly 349	-	expression tag
Gly 350	-	expression tag
Gly 351	-	expression tag
Gly 352	-	expression tag
Ser 353	-	expression tag
Ser 354	-	expression tag
Gly 355	-	expression tag
Val 356	-	expression tag
Ser 357	-	expression tag
Gly 358	-	expression tag
Trp 359	-	expression tag
Arg 360	-	expression tag
Leu 361	-	expression tag
Phe 362	-	expression tag
Lys 363	-	expression tag
Lys 364	-	expression tag
Ile 365	-	expression tag
Ser 366	-	expression tag

R: -30 - -1 (UniProt: P07550)

PDB	External Database	Details
Met -69	-	initiating methionine
Asp -68	-	expression tag
Ser -67	-	expression tag
Lys -66	-	expression tag
Gly -65	-	expression tag
Ser -64	-	expression tag
Ser -63	-	expression tag
Gln -62	-	expression tag
Lys -61	-	expression tag
Gly -60	-	expression tag
Ser -59	-	expression tag
Arg -58	-	expression tag
Leu -57	-	expression tag
Leu -56	-	expression tag
Leu -55	-	expression tag
Leu -54	-	expression tag
Leu -53	-	expression tag
Val -52	-	expression tag
Val -51	-	expression tag
Ser -50	-	expression tag
Asn -49	-	expression tag
Leu -48	-	expression tag
Leu -47	-	expression tag
Leu -46	-	expression tag
Cys -45	-	expression tag
Gln -44	-	expression tag
Gly -43	-	expression tag
Val -42	-	expression tag
Val -41	-	expression tag
Ser -40	-	expression tag
Asp -39	-	expression tag
Tyr -38	-	expression tag
Lys -37	-	expression tag
Asp -36	-	expression tag
Asp -35	-	expression tag
Asp -34	-	expression tag
Asp -33	-	expression tag
Val -32	-	expression tag
Asp -31	-	expression tag
Gln -4	Glu 27	conflict
Ala 0	-	linker
Ser 1	-	linker

R: 2 - 367 (UniProt: P21728)
R: 368 - 533 (PDB: 9WEU)

Contents of the asymmetric unit

Polymers	Number of chains	5
	Total formula weight	161028.9
Non-Polymers*	Number of molecules	8
	Total formula weight	2656.4
All*	Total formula weight	163685.3

*Water molecules are not included.