4OBQ
MAP4K4 in complex with inhibitor (compound 31), N-[3-(4-AMINOQUINAZOLIN-6-YL)-5-FLUOROPHENYL]-2-(PYRROLIDIN-1-YL)ACETAMIDE
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B (A, B) | Mitogen-activated protein kinase kinase kinase kinase 4 | polymer | 332 | 37870.1 | 2 | UniProt (O95819) Pfam (PF00069) | Homo sapiens (human) | HPK/GCK-like kinase HGK, MAPK/ERK kinase kinase kinase 4, MEK kinase kinase 4, MEKKK 4, Nck-interacting kinase |
| 2 | C (A) | 2-(N-MORPHOLINO)-ETHANESULFONIC ACID | non-polymer | 195.2 | 1 | Chemie (MES) | |||
| 3 | D (A) | MAGNESIUM ION | non-polymer | 24.3 | 1 | Chemie (MG) | |||
| 4 | E (A) | N-[3-(4-aminoquinazolin-6-yl)-5-fluorophenyl]-2-(pyrrolidin-1-yl)acetamide | non-polymer | 365.4 | 1 | Chemie (2QT) | |||
| 5 | F, G (A, B) | water | water | 18.0 | 222 | Chemie (HOH) |
Sequence modifications
A, B: 2 - 328 (UniProt: O95819)
| PDB | External Database | Details |
|---|---|---|
| Gly 0 | - | expression tag |
| Ser 1 | - | expression tag |
| Gly 329 | - | expression tag |
| Asn 330 | - | expression tag |
| Ser 331 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 75740.2 | |
| Non-Polymers* | Number of molecules | 3 |
| Total formula weight | 584.9 | |
| All* | Total formula weight | 76325.1 |
