8QUF
carbonic anhydrase XII mimic in complex with 2-(3-((N-(4-sulfamoylbenzyl)pyridine-3-sulfonamido)methyl)phenoxy)acetic acid
This is a non-PDB format compatible entry.
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (AAA) | Carbonic anhydrase 2 | polymer | 260 | 29233.9 | 1 | UniProt (P00918) Pfam (PF00194) | Homo sapiens (human) | Carbonate dehydratase II,Carbonic anhydrase C,CAC,Carbonic anhydrase II,CA-II,Cyanamide hydratase CA2 |
| 2 | B (AAA) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 1 | Chemie (DMS) PubChem (679) | |||
| 3 | C (AAA) | ZINC ION | non-polymer | 65.4 | 1 | Chemie (ZN) | |||
| 4 | D, E (AAA) | 2-[3-[[pyridin-3-ylsulfonyl-[(4-sulfamoylphenyl)methyl]amino]methyl]phenoxy]ethanoic acid | non-polymer | 491.5 | 2 | Chemie (WYZ) PubChem (172055172) | |||
| 5 | F (AAA) | water | water | 18.0 | 273 | Chemie (HOH) |
Sequence modifications
AAA: 1 - 261 (UniProt: P00918)
| PDB | External Database | Details |
|---|---|---|
| Ser 65 | Ala 65 | engineered mutation |
| Lys 67 | Asn 67 | engineered mutation |
| Asn 69 | Glu 69 | engineered mutation |
| Thr 91 | Ile 91 | engineered mutation |
| Ala 131 | Phe 130 | conflict |
| Ser 132 | Gly 131 | conflict |
| Ser 135 | Val 134 | conflict |
| Asn 204 | Leu 203 | engineered mutation |
| Thr 206 | Cys 205 | conflict |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 29233.9 | |
| Non-Polymers* | Number of molecules | 4 |
| Total formula weight | 1126.6 | |
| All* | Total formula weight | 30360.5 |
