7T7L
Structure of human G9a SET-domain (EHMT2) in complex with covalent inhibitor (Compound 1)
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, D | Histone-lysine N-methyltransferase EHMT2 | polymer | 283 | 32604.9 | 4 | UniProt (Q96KQ7) Pfam (PF05033) Pfam (PF00856) In PDB | Homo sapiens (human) | Euchromatic histone-lysine N-methyltransferase 2,HLA-B-associated transcript 8,Histone H3-K9 methyltransferase 3,H3-K9-HMTase 3,Lysine N-methyltransferase 1C,Protein G9a |
| 2 | A, B, C, D | ZINC ION | non-polymer | 65.4 | 16 | Chemie (ZN) | |||
| 3 | D, A, B, C | S-ADENOSYLMETHIONINE | non-polymer | 398.4 | 4 | Chemie (SAM) | |||
| 4 | D, A, B | N-(6-methoxy-4-{[1-(propan-2-yl)piperidin-4-yl]amino}-7-[3-(pyrrolidin-1-yl)propoxy]quinazolin-2-yl)propanamide | non-polymer | 498.7 | 3 | Chemie (G5U) | |||
| 5 | C | N-(6-methoxy-4-{[1-(propan-2-yl)piperidin-4-yl]amino}-7-[3-(pyrrolidin-1-yl)propoxy]quinazolin-2-yl)prop-2-enamide | non-polymer | 496.6 | 1 | Chemie (G4R) | |||
| 6 | water | water | 18.0 | 345 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 913 - 1193 (UniProt: Q96KQ7)
| PDB | External Database | Details |
|---|---|---|
| Gly 911 | - | expression tag |
| Ser 912 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 130419.7 | |
| Non-Polymers* | Number of molecules | 24 |
| Total formula weight | 4632.9 | |
| All* | Total formula weight | 135052.6 |
