8JJ8

Cryo-EM structure of the beta2AR-mBRIL/1b3 Fab/Glue complex with a partial agonist

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	F	Beta-2 adrenergic receptor,Soluble cytochrome b562	polymer	453	51594.1	1	UniProt (P07550) UniProt (P0ABE7) Pfam (PF00001) Pfam (PF07361) In PDB	Homo sapiens (human)	Beta-2 adrenoreceptor,Beta-2 adrenoceptor,Cytochrome b-562
2	F	~{N}-[5-[(1~{R})-2-[[(2~{R})-1-(4-methoxyphenyl)propan-2-yl]amino]-1-oxidanyl-ethyl]-2-oxidanyl-phenyl]methanamide	non-polymer		344.4	1	Chemie (H98)

Sequence modifications

F: 29 - 230 (UniProt: P07550)

PDB	External Database	Details
Met 5	-	initiating methionine
Lys 6	-	expression tag
Thr 7	-	expression tag
Ile 8	-	expression tag
Ile 9	-	expression tag
Ala 10	-	expression tag
Leu 11	-	expression tag
Ser 12	-	expression tag
Tyr 13	-	expression tag
Ile 14	-	expression tag
Phe 15	-	expression tag
Cys 16	-	expression tag
Leu 17	-	expression tag
Val 18	-	expression tag
Phe 19	-	expression tag
Ala 20	-	expression tag
Asp 21	-	expression tag
Tyr 22	-	expression tag
Lys 23	-	expression tag
Asp 24	-	expression tag
Asp 25	-	expression tag
Asp 26	-	expression tag
Asp 27	-	expression tag
Lys 28	-	expression tag
Glu 187	Asn 187	conflict

F: 231 - 329 (UniProt: P0ABE7)

PDB	External Database	Details
Trp 237	Met 29	conflict
Ser 274	Thr 66	linker
Gly 275	Pro 67	linker
Ser 276	Pro 68	linker
Gly 277	Lys 69	linker
-	Leu 70	deletion
-	Glu 71	deletion
-	Asp 72	deletion
-	Lys 73	deletion
Ile 325	His 124	conflict
Leu 329	Arg 128	conflict

F: 330 - 407 (UniProt: P07550)

PDB	External Database	Details
Ser 394	Cys 327	conflict
Lys 408	-	expression tag
Ile 409	-	expression tag
Ala 410	-	expression tag
Ala 411	-	expression tag
Leu 412	-	expression tag
Lys 413	-	expression tag
Glu 414	-	expression tag
Lys 415	-	expression tag
Ile 416	-	expression tag
Ala 417	-	expression tag
Ala 418	-	expression tag
Leu 419	-	expression tag
Lys 420	-	expression tag
Glu 421	-	expression tag
Lys 422	-	expression tag
Ile 423	-	expression tag
Ala 424	-	expression tag
Ala 425	-	expression tag
Leu 426	-	expression tag
Lys 427	-	expression tag
Glu 428	-	expression tag
Ala 429	-	expression tag
Glu 430	-	expression tag
Glu 431	-	expression tag
Lys 432	-	expression tag
Arg 433	-	expression tag
Ala 434	-	expression tag
Ser 435	-	expression tag
Arg 436	-	expression tag
Leu 437	-	expression tag
Glu 438	-	expression tag
Glu 439	-	expression tag
Glu 440	-	expression tag
Leu 441	-	expression tag
Arg 442	-	expression tag
Arg 443	-	expression tag
Arg 444	-	expression tag
Leu 445	-	expression tag
Thr 446	-	expression tag
Glu 447	-	expression tag
Gly 448	-	expression tag
Ser 449	-	expression tag
His 450	-	expression tag
His 451	-	expression tag
His 452	-	expression tag
His 453	-	expression tag
His 454	-	expression tag
His 455	-	expression tag
His 456	-	expression tag
His 457	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	1
	Total formula weight	51594.1
Non-Polymers*	Number of molecules	1
	Total formula weight	344.4
All*	Total formula weight	51938.5

*Water molecules are not included.