4OB2
Crystal Structure of Nitrile Hydratase from Pseudonocardia thermophila bound to Butaneboronic Acid via Crystal Soaking
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (A) | Cobalt-containing nitrile hydratase subunit alpha | polymer | 209 | 23901.3 | 1 | UniProt (Q7SID2) Pfam (PF02979) | Pseudonocardia thermophila | L-NHase, L-nitrilase |
| 2 | B (B) | Cobalt-containing nitrile hydratase subunit beta | polymer | 233 | 26583.6 | 1 | UniProt (Q7SID3) Pfam (PF21006) Pfam (PF02211) | Pseudonocardia thermophila | L-NHase, L-nitrilase |
| 3 | C (A) | 1-BUTANE BORONIC ACID | non-polymer | 101.9 | 1 | Chemie (BUB) | |||
| 4 | D (A) | COBALT (II) ION | non-polymer | 58.9 | 1 | Chemie (CO) | |||
| 5 | E, F, G, H, R... (A, B) | GLYCEROL | non-polymer | 92.1 | 8 | Chemie (GOL) | |||
| 6 | AA, BA, CA, DA, EA... (B, A) | METHANOL | non-polymer | 32.0 | 24 | Chemie (MOH) | |||
| 7 | KA, LA (A, B) | water | water | 18.0 | 550 | Chemie (HOH) |
Sequence modifications
A: 2 - 204 (UniProt: Q7SID2)
| PDB | External Database | Details |
|---|---|---|
| His 205 | - | expression tag |
| His 206 | - | expression tag |
| His 207 | - | expression tag |
| His 208 | - | expression tag |
| His 209 | - | expression tag |
| His 210 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 2 |
| Total formula weight | 50484.9 | |
| Non-Polymers* | Number of molecules | 34 |
| Total formula weight | 1666.6 | |
| All* | Total formula weight | 52151.6 |
