6GXE
Carbonic Anhydrase CAIX mimic in complex with inhibitor JS14
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A | Carbonic anhydrase 2 | polymer | 257 | 28844.5 | 1 | UniProt (P00918) Pfam (PF00194) In PDB | Homo sapiens (Human) | Carbonate dehydratase II,Carbonic anhydrase C,CAC,Carbonic anhydrase II,CA-II |
| 2 | A | ZINC ION | non-polymer | 65.4 | 1 | Chemie (ZN) | |||
| 3 | A | 3-[2-[2-[2-[2-(aminomethyloxy)ethoxy]ethoxy]ethoxy]ethoxy]-~{N}-[4-[4-[(4-sulfamoylphenyl)carbamoylamino]phenoxy]butyl]propanamide | non-polymer | 655.8 | 2 | Chemie (FFH) | |||
| 4 | A | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 1 | Chemie (DMS) | |||
| 5 | water | water | 18.0 | 232 | Chemie (HOH) |
Sequence modifications
A: 4 - 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 |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 28844.5 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 1455.1 | |
| All* | Total formula weight | 30299.5 |
