4ER3
Crystal Structure of Human DOT1L in complex with inhibitor EPZ004777
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Histone-lysine N-methyltransferase, H3 lysine-79 specific | polymer | 352 | 40808.3 | 1 | UniProt (Q8TEK3) Pfam (PF08123) | Homo sapiens (human) | DOT1-like protein, Histone H3-K79 methyltransferase, H3-K79-HMTase, Lysine N-methyltransferase 4 |
| 2 | B (A) | 7-{5-[(3-{[(4-tert-butylphenyl)carbamoyl]amino}propyl)(propan-2-yl)amino]-5-deoxy-beta-D-ribofuranosyl}-7H-pyrrolo[2,3-d]pyrimidin-4-amine | non-polymer | 539.7 | 1 | Chemie (0QK) PubChem (56962336) PubChem (89911625) PubChem (121405800) PubChem (173939491) PubChem (67811139) PubChem (70702060) PubChem (76450046) PubChem (86765433) PubChem (90367749) PubChem (118425046) PubChem (118885623) PubChem (124080926) PubChem (124224096) PubChem (124224097) PubChem (124224098) PubChem (125113119) PubChem (132070303) PubChem (134695328) PubChem (138107147) | |||
| 3 | C, D, E, F, G (A) | SULFATE ION | non-polymer | 96.1 | 5 | Chemie (SO4) | |||
| 4 | H, I (A) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 2 | Chemie (EDO) | |||
| 5 | J, K, L, M, N... (A) | UNKNOWN ATOM OR ION | non-polymer | 6 | Chemie (UNX) | ||||
| 6 | P (A) | water | water | 18.0 | 18 | Chemie (HOH) |
Sequence modifications
A: 1 - 351 (UniProt: Q8TEK3)
| PDB | External Database | Details |
|---|---|---|
| Gly 0 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 40808.3 | |
| Non-Polymers* | Number of molecules | 14 |
| Total formula weight | 1144.1 | |
| All* | Total formula weight | 41952.4 |
