5OGN
Metalacarborane inhibitors of Carbonic Anhydrase IX
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) | Carbonic anhydrase 2 | polymer | 259 | 29120.8 | 2 | UniProt (P00918) Pfam (PF00194) | Homo sapiens (Human) | Carbonate dehydratase II,Carbonic anhydrase C,CAC,Carbonic anhydrase II,CA-II |
| 2 | C, E, F (A, B) | ZINC ION | non-polymer | 65.4 | 3 | Chemie (ZN) | |||
| 3 | D, G (A, B) | cobaltcarborane | non-polymer | 424.7 | 2 | Chemie (B8B) | |||
| 4 | H, I (A, B) | water | water | 18.0 | 328 | Chemie (HOH) |
Sequence modifications
A, B: 3 - 260 (UniProt: P00918)
| PDB | External Database | Details |
|---|---|---|
| His 2 | - | expression tag |
| Ser 65 | Ala 65 | conflict |
| Gln 67 | Asn 67 | conflict |
| Thr 69 | Glu 69 | conflict |
| Leu 91 | Ile 91 | conflict |
| Val 130 | Phe 130 | conflict |
| Glu 169 | Lys 169 | conflict |
| Ala 203 | Leu 203 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 58241.5 | |
| Non-Polymers* | Number of molecules | 5 |
| Total formula weight | 1045.7 | |
| All* | Total formula weight | 59287.2 |
