4FW4
Crystal Structure of the LpxC in complex with N-[(1S,2R)-2-HYDROXY-1-(HYDROXYCARBAMOYL)PROPYL]-4-(4-PHENYLBUTA-1,3-DIYN-1-YL)BENZAMIDE inhibitor
Entity
| Entity ID | Chain ID | Description | Type | Chain length | Formula weight | Number of molecules | DB Name (Accession) | Biological source | Descriptive keywords |
| 1 | A, B, C, D (A, B, C, D) | UDP-3-O-[3-hydroxymyristoyl] N-acetylglucosamine deacetylase | polymer | 302 | 33418.9 | 4 | UniProt (P47205) Pfam (PF03331) | Pseudomonas aeruginosa | Protein envA, UDP-3-O-acyl-GlcNAc deacetylase |
| 2 | E, G, J, N (A, B, C, D) | ZINC ION | non-polymer | 65.4 | 4 | Chemie (ZN) | |||
| 3 | F, H, K, O (A, B, C, D) | N-[(1S,2R)-2-hydroxy-1-(hydroxycarbamoyl)propyl]-4-(4-phenylbuta-1,3-diyn-1-yl)benzamide | non-polymer | 362.4 | 4 | Chemie (3P3) | |||
| 4 | I, L, P (B, C, D) | GLYCEROL | non-polymer | 92.1 | 3 | Chemie (GOL) | |||
| 5 | M (C) | ACETATE ION | non-polymer | 59.0 | 1 | Chemie (ACT) | |||
| 6 | Q, R, S, T (A, B, C, D) | water | water | 18.0 | 395 | Chemie (HOH) |
Sequence modifications
A, B, C, D: 1 - 299 (UniProt: P47205)
| PDB | External Database | Details |
|---|---|---|
| Ser -2 | - | expression tag |
| Asn -1 | - | expression tag |
| Ala 0 | - | expression tag |
| Ser 40 | Cys 40 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 4 |
| Total formula weight | 133675.5 | |
| Non-Polymers* | Number of molecules | 12 |
| Total formula weight | 2046.5 | |
| All* | Total formula weight | 135722.0 |
