9PY2

Engaged-state loperamide-mu opioid receptor-Gi GDPbS complex (rebound)

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 (R)	Soluble cytochrome b562,Mu-type opioid receptor	polymer	622	69540.4	1	UniProt (P0ABE7) UniProt (P35372)	Homo sapiens (human)	Cytochrome b-562,M-OR-1,MOR-1,Mu opiate receptor,Mu opioid receptor,MOP,hMOP
2	B (A)	Guanine nucleotide-binding protein G(i) subunit alpha-1	polymer	354	40415.0	1	UniProt (P63096)	Homo sapiens (human)	Adenylate cyclase-inhibiting G alpha protein
3	C (B)	Guanine nucleotide-binding protein G(I)/G(S)/G(T) subunit beta-1	polymer	361	39839.5	1	UniProt (P62873)	Homo sapiens (human)	Transducin beta chain 1
4	D (C)	Guanine nucleotide-binding protein G(I)/G(S)/G(O) subunit gamma-2	polymer	71	7861.1	1	UniProt (P59768)	Homo sapiens (human)	G gamma-I
5	E, F (R)	CHOLESTEROL	non-polymer		386.7	2	Chemie (CLR)
6	G (R)	4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-N,N-dimethyl-2,2-diphenylbutanamide	non-polymer		477.0	1	Chemie (A1CMV)
7	H (A)	5'-O-[(R)-hydroxy(thiophosphonooxy)phosphoryl]guanosine	non-polymer		459.3	1	Chemie (VSN)

Sequence modifications

R: -108 - -8 (UniProt: P0ABE7)

PDB	External Database	Details
Met -169	-	expression tag
Lys -168	-	expression tag
Thr -167	-	expression tag
Ile -166	-	expression tag
Ile -165	-	expression tag
Ala -164	-	expression tag
Leu -163	-	expression tag
Ser -162	-	expression tag
Tyr -161	-	expression tag
Ile -160	-	expression tag
Phe -159	-	expression tag
Cys -158	-	expression tag
Leu -157	-	expression tag
Val -156	-	expression tag
Phe -155	-	expression tag
Ala -154	-	expression tag
Asp -153	-	expression tag
Tyr -152	-	expression tag
Lys -151	-	expression tag
Asp -150	-	expression tag
His -149	-	expression tag
Asp -148	-	expression tag
Gly -147	-	expression tag
Asp -146	-	expression tag
Tyr -145	-	expression tag
Lys -144	-	expression tag
Asp -143	-	expression tag
His -142	-	expression tag
Asp -141	-	expression tag
Ile -140	-	expression tag
Asp -139	-	expression tag
Tyr -138	-	expression tag
Lys -137	-	expression tag
Asp -136	-	expression tag
Asp -135	-	expression tag
Asp -134	-	expression tag
Asp -133	-	expression tag
Lys -132	-	expression tag
Leu -131	-	expression tag
His -130	-	expression tag
His -129	-	expression tag
His -128	-	expression tag
His -127	-	expression tag
His -126	-	expression tag
His -125	-	expression tag
His -124	-	expression tag
His -123	-	expression tag
His -122	-	expression tag
His -121	-	expression tag
Leu -120	-	expression tag
Glu -119	-	expression tag
Val -118	-	expression tag
Leu -117	-	expression tag
Phe -116	-	expression tag
Gln -115	-	expression tag
Gly -114	-	expression tag
Pro -113	-	expression tag
Gly -112	-	expression tag
Ser -111	-	expression tag
Gly -110	-	expression tag
Ser -109	-	expression tag
Trp -102	Met 29	conflict
Ile -7	-	linker
Gln -6	-	linker
Lys -5	-	linker
Tyr -4	-	linker
Leu -3	-	linker
Gly -2	-	linker
Thr -1	-	linker
Gly 0	-	linker
Ser 1	-	linker

R: 2 - 400 (UniProt: P35372)

PDB	External Database	Details
Ala 401	-	expression tag
Ala 402	-	expression tag
Ala 403	-	expression tag
Leu 404	-	expression tag
Glu 405	-	expression tag
Val 406	-	expression tag
Leu 407	-	expression tag
Phe 408	-	expression tag
Gln 409	-	expression tag
Gly 410	-	expression tag
Pro 411	-	expression tag
Gly 412	-	expression tag
Ser 413	-	expression tag
Trp 414	-	expression tag
Ser 415	-	expression tag
His 416	-	expression tag
Pro 417	-	expression tag
Gln 418	-	expression tag
Phe 419	-	expression tag
Glu 420	-	expression tag
Lys 421	-	expression tag
Gly 422	-	expression tag
Gly 423	-	expression tag
Gly 424	-	expression tag
Ser 425	-	expression tag
Gly 426	-	expression tag
Gly 427	-	expression tag
Gly 428	-	expression tag
Ser 429	-	expression tag
Gly 430	-	expression tag
Gly 431	-	expression tag
Ser 432	-	expression tag
Ser 433	-	expression tag
Ala 434	-	expression tag
Trp 435	-	expression tag
Ser 436	-	expression tag
His 437	-	expression tag
Pro 438	-	expression tag
Gln 439	-	expression tag
Phe 440	-	expression tag
Glu 441	-	expression tag
Lys 442	-	expression tag
His 443	-	expression tag
His 444	-	expression tag
His 445	-	expression tag
His 446	-	expression tag
His 447	-	expression tag
His 448	-	expression tag
His 449	-	expression tag
His 450	-	expression tag
His 451	-	expression tag
His 452	-	expression tag

B: 2 - 340 (UniProt: P62873)

PDB	External Database	Details
His -20	-	expression tag
His -19	-	expression tag
His -18	-	expression tag
His -17	-	expression tag
His -16	-	expression tag
His -15	-	expression tag
His -14	-	expression tag
His -13	-	expression tag
His -12	-	expression tag
His -11	-	expression tag
Leu -10	-	expression tag
Glu -9	-	expression tag
Val -8	-	expression tag
Leu -7	-	expression tag
Phe -6	-	expression tag
Gln -5	-	expression tag
Gly -4	-	expression tag
Pro -3	-	expression tag
Gly -2	-	expression tag
Ser -1	-	expression tag
Ser 0	-	expression tag
Gly 1	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	4
	Total formula weight	157656.0
Non-Polymers*	Number of molecules	4
	Total formula weight	1709.6
All*	Total formula weight	159365.6

*Water molecules are not included.