6YI6
Structural and Kinetic Evaluation of Phosphoramidate Inhibitors on Thermolysin
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A (E) | Thermolysin | polymer | 316 | 34360.3 | 1 | UniProt (P43133) Pfam (PF01447) Pfam (PF02868) | Geobacillus stearothermophilus | Neutral protease |
| 2 | B (E) | ZINC ION | non-polymer | 65.4 | 1 | Chemie (ZN) | |||
| 3 | C, D, E, F (E) | CALCIUM ION | non-polymer | 40.1 | 4 | Chemie (CA) | |||
| 4 | G, H (E) | CESIUM ION | non-polymer | 132.9 | 2 | Chemie (CS) | |||
| 5 | I, J, K, L (E) | DIMETHYL SULFOXIDE | non-polymer | 78.1 | 4 | Chemie (DMS) | |||
| 6 | M (E) | (2~{S})-2-[[(2~{S})-4-methyl-2-[[oxidanyl-[(1~{S})-2-phenyl-1-(phenylmethoxycarbonylamino)ethyl]phosphoryl]amino]pentanoyl]amino]propanoic acid | non-polymer | 519.5 | 1 | Chemie (ORK) | |||
| 7 | N (E) | water | water | 18.0 | 361 | Chemie (HOH) |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 1 |
| Total formula weight | 34360.3 | |
| Non-Polymers* | Number of molecules | 12 |
| Total formula weight | 1323.6 | |
| All* | Total formula weight | 35683.9 |
