6DDI
Crystal Structure of the human BRD2 BD1 bromodomain in complex with a Tetrahydroquinoline analogue
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C (A, B, C) | Bromodomain-containing protein 2 | polymer | 138 | 16150.8 | 3 | UniProt (P25440) Pfam (PF00439) | Homo sapiens (Human) | O27.1.1,Really interesting new gene 3 protein |
| 2 | D, H, K (A, B, C) | 4-{[(2S,4R)-1-acetyl-2-methyl-6-(1H-pyrazol-3-yl)-1,2,3,4-tetrahydroquinolin-4-yl]amino}benzonitrile | non-polymer | 371.4 | 3 | Chemie (G7V) | |||
| 3 | E (A) | SULFATE ION | non-polymer | 96.1 | 1 | Chemie (SO4) | |||
| 4 | F, G, J (A, B) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 3 | Chemie (EDO) | |||
| 5 | I (B) | methanesulfonic acid | non-polymer | 96.1 | 1 | Chemie (03S) | |||
| 6 | L, M, N (A, B, C) | water | water | 18.0 | 249 | Chemie (HOH) |
Sequence modifications
A, B, C: 67 - 200 (UniProt: P25440)
| PDB | External Database | Details |
|---|---|---|
| Gly 63 | - | expression tag |
| Ser 64 | - | expression tag |
| His 65 | - | expression tag |
| Met 66 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 48452.5 | |
| Non-Polymers* | Number of molecules | 8 |
| Total formula weight | 1492.7 | |
| All* | Total formula weight | 49945.2 |
