6S03
Carbonic Anhydrase CAIX mimic in complex with inhibitor I39LT379
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Carbonic anhydrase 2 | polymer | 260 | 29186.9 | 1 | UniProt (P00918) Pfam (PF00194) | Homo sapiens (Human) | Carbonate dehydratase II,Carbonic anhydrase C,CAC,Carbonic anhydrase II,CA-II |
| 2 | B (A) | ZINC ION | non-polymer | 65.4 | 1 | Chemie (ZN) | |||
| 3 | C (A) | 4-[[4-[5,5-dimethyl-2-(6-methylpyridin-2-yl)-4,6-dihydropyrrolo[1,2-b]pyrazol-3-yl]pyridin-2-yl]amino]benzenesulfonamide | non-polymer | 474.6 | 1 | Chemie (KPW) | |||
| 4 | D (A) | water | water | 18.0 | 211 | Chemie (HOH) |
Sequence modifications
A: 1 - 260 (UniProt: P00918)
| PDB | External Database | Details |
|---|---|---|
| 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 |
| Val 223 | Leu 223 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 29186.9 | |
| Non-Polymers* | Number of molecules | 2 |
| Total formula weight | 540.0 | |
| All* | Total formula weight | 29726.8 |
