6QWA
Crystal structure of KPC-3 complexed with relebactam (16 hour soak)
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A | Beta-lactamase | polymer | 290 | 30831.7 | 1 | UniProt (Q93DC4) Pfam (PF00144) Pfam (PF13354) UniProt (by SIFTS) (Q9F663) In PDB | Klebsiella pneumoniae | |
2 | A | SULFATE ION | non-polymer | 96.1 | 2 | Chemie (SO4) | |||
3 | A | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) | |||
4 | A | ETHANOL | non-polymer | 46.1 | 1 | Chemie (EOH) | |||
5 | A | (2S,5R)-1-formyl-N-(piperidin-4-yl)-5-[(sulfooxy)amino]piperidine-2-carboxamide | non-polymer | 350.4 | 1 | Chemie (MK7) | |||
6 | A | (2~{S})-5-azanylidene-2-(piperidin-4-ylcarbamoyl)piperidine-1-carboxylic acid | non-polymer | 268.3 | 1 | Chemie (JJT) | |||
7 | water | water | 18.0 | 373 | Chemie (HOH) |
Sequence modifications
A: 25 - 295 (UniProt: Q93DC4)
PDB | External Database | Details |
---|---|---|
Met 4 | - | initiating methionine |
Gly 5 | - | expression tag |
Ser 6 | - | expression tag |
Ser 7 | - | expression tag |
His 8 | - | expression tag |
His 9 | - | expression tag |
His 10 | - | expression tag |
His 11 | - | expression tag |
His 12 | - | expression tag |
His 13 | - | expression tag |
Ser 14 | - | expression tag |
Ser 15 | - | expression tag |
Gly 16 | - | expression tag |
Leu 17 | - | expression tag |
Val 18 | - | expression tag |
Pro 19 | - | expression tag |
Arg 20 | - | expression tag |
Gly 21 | - | expression tag |
Ser 22 | - | expression tag |
His 23 | - | expression tag |
Met 24 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 1 |
Total formula weight | 30831.7 | |
Non-Polymers* | Number of molecules | 6 |
Total formula weight | 949.0 | |
All* | Total formula weight | 31780.6 |