2OZR
MMP13 Catalytic Domain Complexed with 4-{[1-methyl-2,4-dioxo-6-(3-phenylprop-1-yn-1-yl)-1,4-dihydroquinazolin-3(2H)-yl]methyl}benzoic acid
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, E... | Collagenase 3 | polymer | 170 | 19069.3 | 8 | UniProt (P45452) Pfam (PF00413) In PDB | Homo sapiens (human) | Matrix metalloproteinase-13, MMP-13 |
| 2 | D, H, A, E, B... | ZINC ION | non-polymer | 65.4 | 16 | Chemie (ZN) | |||
| 3 | G, D, H, A, E... | CALCIUM ION | non-polymer | 40.1 | 24 | Chemie (CA) | |||
| 4 | G, D, H, A, E... | 4-{[1-METHYL-2,4-DIOXO-6-(3-PHENYLPROP-1-YN-1-YL)-1,4-DIHYDROQUINAZOLIN-3(2H)-YL]METHYL}BENZOIC ACID | non-polymer | 424.4 | 8 | Chemie (GG1) | |||
| 5 | C, D, E, F | ACETOHYDROXAMIC ACID | non-polymer | 75.1 | 4 | Chemie (HAE) | |||
| 6 | water | water | 18.0 | 1024 | Chemie (HOH) |
Sequence modifications
A, B, C, D, E, F, G, H: 83 - 249 (UniProt: P45452)
| PDB | External Database | Details |
|---|---|---|
| Met 80 | - | expression tag |
| Ala 81 | - | expression tag |
| Ser 82 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 8 |
| Total formula weight | 152554.5 | |
| Non-Polymers* | Number of molecules | 52 |
| Total formula weight | 5704.3 | |
| All* | Total formula weight | 158258.8 |
