1S17
Identification of Novel Potent Bicyclic Peptide Deformylase Inhibitors
Entity
Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
1 | A, B | Peptide deformylase | polymer | 180 | 20866.8 | 2 | UniProt (Q9I7A8) Pfam (PF01327) In PDB | Pseudomonas aeruginosa | PDF, Polypeptide deformylase |
2 | A, B | NICKEL (II) ION | non-polymer | 58.7 | 2 | Chemie (NI) | |||
3 | A, B | 2-(3,4-DIHYDRO-3-OXO-2H-BENZO[B][1,4]THIAZIN-2-YL)-N-HYDROXYACETAMIDE | non-polymer | 238.3 | 2 | Chemie (GNR) | |||
4 | A | GLYCEROL | non-polymer | 92.1 | 1 | Chemie (GOL) | |||
5 | water | water | 18.0 | 208 | Chemie (HOH) |
Sequence modifications
A, B: 1 - 168 (UniProt: Q9I7A8)
PDB | External Database | Details |
---|---|---|
Met -11 | - | expression tag |
Gly -10 | - | expression tag |
Ser -9 | - | expression tag |
Asp -8 | - | expression tag |
Lys -7 | - | expression tag |
Ile -6 | - | expression tag |
His -5 | - | expression tag |
His -4 | - | expression tag |
His -3 | - | expression tag |
His -2 | - | expression tag |
His -1 | - | expression tag |
His 0 | - | expression tag |
Glu 84 | Asp 84 | conflict |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 2 |
Total formula weight | 41733.6 | |
Non-Polymers* | Number of molecules | 5 |
Total formula weight | 686.0 | |
All* | Total formula weight | 42419.6 |