8G3E
Crystal structure of human WDR5 in complex with (1M)-N-[(3,5-difluoro[1,1'-biphenyl]-4-yl)methyl]-6-methyl-4-oxo-1-(pyridin-3-yl)-1,4-dihydropyridazine-3-carboxamide (compound 2, WDR5-MYC inhibitor)
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B | WD repeat-containing protein 5 | polymer | 316 | 34663.3 | 2 | UniProt (P61964) Pfam (PF00400) In PDB | Homo sapiens (human) | BMP2-induced 3-kb gene protein |
| 2 | A, B | (1M)-N-[(3,5-difluoro[1,1'-biphenyl]-4-yl)methyl]-6-methyl-4-oxo-1-(pyridin-3-yl)-1,4-dihydropyridazine-3-carboxamide | non-polymer | 432.4 | 2 | Chemie (YJR) | |||
| 3 | water | water | 18.0 | 620 | Chemie (HOH) |
Sequence modifications
A, B: 22 - 334 (UniProt: P61964)
| PDB | External Database | Details |
|---|---|---|
| Ser 19 | - | expression tag |
| Asn 20 | - | expression tag |
| Ala 21 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 69326.5 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 864.8 | |
| All* | Total formula weight | 70191.3 |
