6G3O
Crystal structure of human HDAC2 in complex with (R)-6-[3,4-Dioxo-2-(4-trifluoromethoxy-phenylamino)-cyclobut-1-enylamino]-heptanoic acid hydroxyamide
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 | Histone deacetylase 2 | polymer | 370 | 42424.3 | 3 | UniProt (Q92769) Pfam (PF00850) In PDB | Homo sapiens (Human) | HD2 |
| 2 | A, B, C | ZINC ION | non-polymer | 65.4 | 3 | Chemie (ZN) | |||
| 3 | A, B, C | CALCIUM ION | non-polymer | 40.1 | 3 | Chemie (CA) | |||
| 4 | A, B, C | SODIUM ION | non-polymer | 23.0 | 3 | Chemie (NA) | |||
| 5 | A, B, C | (6~{R})-6-[[3,4-bis(oxidanylidene)-2-[[4-(trifluoromethyloxy)phenyl]amino]cyclobuten-1-yl]amino]-~{N}-oxidanyl-heptanamide | non-polymer | 415.4 | 3 | Chemie (EL8) | |||
| 6 | B | PENTAETHYLENE GLYCOL | non-polymer | 238.3 | 1 | Chemie (1PE) | |||
| 7 | B, C | SULFATE ION | non-polymer | 96.1 | 2 | Chemie (SO4) | |||
| 8 | B | TETRAETHYLENE GLYCOL | non-polymer | 194.2 | 1 | Chemie (PG4) | |||
| 9 | water | water | 18.0 | 469 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 3 |
| Total formula weight | 127272.9 | |
| Non-Polymers* | Number of molecules | 16 |
| Total formula weight | 2256.2 | |
| All* | Total formula weight | 129529.0 |
