5F8U

Ligand occupancy in crystal structure of beta1-adrenergic receptor previously submitted by Huang et al

Entity

Entity ID	Chain ID	Description	Type	Chain length	Formula weight	Number of molecules	DB Name (Accession)	Biological source	Descriptive keywords
1	A, B (B, A)	Beta-1 adrenergic receptor	polymer	313	35752.6	2	UniProt (P07700) Pfam (PF00001)	Meleagris gallopavo (turkey)	Beta-1 adrenoreceptor,Beta-T
2	C, D (B, A)	Cyanopindolol	non-polymer		287.4	2	Chemie (P32)

Sequence modifications

B, A: 33 - 368 (UniProt: P07700)

PDB	External Database	Details
Met 31	-	initiating methionine
Gly 32	-	expression tag
Ser 68	Arg 68	engineered mutation
Val 90	Met 90	engineered mutation
Leu 116	Cys 116	engineered mutation
Ala 227	Tyr 227	engineered mutation
-	Cys 244	deletion
-	Glu 245	deletion
-	Gly 246	deletion
-	Arg 247	deletion
-	Phe 248	deletion
-	Tyr 249	deletion
-	Gly 250	deletion
-	Ser 251	deletion
-	Gln 252	deletion
-	Glu 253	deletion
-	Gln 254	deletion
-	Pro 255	deletion
-	Gln 256	deletion
-	Pro 257	deletion
-	Pro 258	deletion
-	Pro 259	deletion
-	Leu 260	deletion
-	Pro 261	deletion
-	Gln 262	deletion
-	His 263	deletion
-	Gln 264	deletion
-	Pro 265	deletion
-	Ile 266	deletion
-	Leu 267	deletion
-	Gly 268	deletion
-	Asn 269	deletion
-	Gly 270	deletion
-	Arg 271	deletion
-	Thr 277	deletion
-	Ser 278	deletion
Leu 282	Ala 282	engineered mutation
Ala 327	Phe 327	engineered mutation
Met 338	Phe 338	engineered mutation
Ala 358	Cys 358	engineered mutation
His 369	-	expression tag
His 370	-	expression tag
His 371	-	expression tag
His 372	-	expression tag
His 373	-	expression tag

Contents of the asymmetric unit

Polymers	Number of chains	2
	Total formula weight	71505.2
Non-Polymers*	Number of molecules	2
	Total formula weight	574.7
All*	Total formula weight	72079.9

*Water molecules are not included.