5S9O
CRYSTAL STRUCTURE OF THE HUMAN BRD2 BD1 BROMODOMAIN IN COMPLEX WITH 9-(cyclopropylmethyl)-7-[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazole-1-carboxamide
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | Bromodomain-containing protein 2 | polymer | 144 | 16982.6 | 2 | UniProt (A0A140T9E9) Pfam (PF00439) UniProt (by SIFTS) (P25440) In PDB | Homo sapiens (Human) | |
2 | A, B | 9-(cyclopropylmethyl)-7-[(2R,6S)-2,6-dimethylmorpholine-4-carbonyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazole-1-carboxamide | non-polymer | 500.6 | 2 | Chemie (YW1) | |||
3 | A, B | 1,2-ETHANEDIOL | non-polymer | 62.1 | 9 | Chemie (EDO) | |||
4 | water | water | 18.0 | 95 | Chemie (HOH) |
Sequence modifications
A, B: 73 - 194 (UniProt: A0A140T9E9)
PDB | External Database | Details |
---|---|---|
Met 51 | - | initiating methionine |
Gly 52 | - | expression tag |
Ser 53 | - | expression tag |
Ser 54 | - | expression tag |
His 55 | - | expression tag |
His 56 | - | expression tag |
His 57 | - | expression tag |
His 58 | - | expression tag |
His 59 | - | expression tag |
His 60 | - | expression tag |
Ser 61 | - | expression tag |
Ser 62 | - | expression tag |
Gly 63 | - | expression tag |
Glu 64 | - | expression tag |
Thr 65 | - | expression tag |
Val 66 | - | expression tag |
Arg 67 | - | expression tag |
Phe 68 | - | expression tag |
Gln 69 | - | expression tag |
Gly 70 | - | expression tag |
His 71 | - | expression tag |
Met 72 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 33965.2 | |
Non-Polymers* | Number of molecules | 11 |
Total formula weight | 1559.8 | |
All* | Total formula weight | 35525.0 |