6TBC
Crystal structure of S. aureus FabI in complex with NADPH and kalimantacin B
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, E... (A, B, C, D, E...) | Enoyl-[acyl-carrier-protein] reductase [NADPH] | polymer | 261 | 28465.3 | 8 | UniProt (A0A0J9X1X7) UniProt (by SIFTS) (Q6GI75) | Staphylococcus aureus | ENR |
| 2 | I, K, M, O, Q... (A, B, C, D, E...) | NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE | non-polymer | 745.4 | 8 | Chemie (NDP) | |||
| 3 | J, L, N, P, R... (A, B, C, D, E...) | (2~{E},5~{R},10~{E},12~{E},15~{S},19~{R})-20-[[(2~{R},3~{R})-3-aminocarbonyloxy-2-methyl-butanoyl]amino]-3,5,15-trimethyl-7-methylidene-19-oxidanyl-17-oxidanylidene-icosa-2,10,12-trienoic acid | non-polymer | 548.7 | 8 | Chemie (N5H) PubChem (197707) PubChem (6444314) PubChem (10482623) PubChem (146014955) PubChem (162996273) PubChem (146014956) PubChem (162996271) PubChem (162996272) PubChem (162996274) PubChem (162996275) | |||
| 4 | AA, BA, CA, DA, EA... (C, D, E, F, G...) | water | water | 18.0 | 23 | Chemie (HOH) |
Sequence modifications
A, B, C, D, E, F, G, H: 3 - 256 (UniProt: A0A0J9X1X7)
| PDB | External Database | Details |
|---|---|---|
| Gly -4 | - | expression tag |
| Ser -3 | - | expression tag |
| His -2 | - | expression tag |
| Met -1 | - | expression tag |
| Ala 0 | - | expression tag |
| Ser 1 | - | expression tag |
| Leu 2 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 8 |
| Total formula weight | 227722.1 | |
| Non-Polymers* | Number of molecules | 16 |
| Total formula weight | 10353.1 | |
| All* | Total formula weight | 238075.2 |
