4BNI
Crystal structure of S. aureus FabI in complex with NADP and 2-(2- aminophenoxy)-5-hexylphenol
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... | ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADPH] | polymer | 282 | 31144.2 | 8 | UniProt (Q7A6D8) Pfam (PF13561) UniProt (by SIFTS) (A0A0H3JLH9) In PDB | STAPHYLOCOCCUS AUREUS SUBSP. AUREUS | ENR, ENOYL-ACP REDUCTASE |
2 | G, A, B, C, F | GLUTAMIC ACID | non-polymer | 147.1 | 7 | Chemie (GLU) | |||
3 | G, H, A, B, C... | 2-(2-azanylphenoxy)-5-hexyl-phenol | non-polymer | 285.4 | 8 | Chemie (P1F) | |||
4 | G, H, A, B, C... | NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE | non-polymer | 743.4 | 8 | Chemie (NAP) | |||
5 | water | water | 18.0 | 1087 | Chemie (HOH) |
Sequence modifications
A, B, C, D, E, F, G, H: 1 - 256 (UniProt: Q7A6D8)
PDB | External Database | Details |
---|---|---|
Met -25 | - | expression tag |
Lys -24 | - | expression tag |
His -23 | - | expression tag |
His -22 | - | expression tag |
His -21 | - | expression tag |
His -20 | - | expression tag |
His -19 | - | expression tag |
His -18 | - | expression tag |
Pro -17 | - | expression tag |
Met -16 | - | expression tag |
Ser -15 | - | expression tag |
Asp -14 | - | expression tag |
Tyr -13 | - | expression tag |
Asp -12 | - | expression tag |
Ile -11 | - | expression tag |
Pro -10 | - | expression tag |
Thr -9 | - | expression tag |
Thr -8 | - | expression tag |
Glu -7 | - | expression tag |
Asn -6 | - | expression tag |
Leu -5 | - | expression tag |
Tyr -4 | - | expression tag |
Phe -3 | - | expression tag |
Gln -2 | - | expression tag |
Gly -1 | - | expression tag |
Ala 0 | - | expression tag |
Val 2 | Leu 2 | engineered mutation |
Sequence viewer
Contents of the asymmetric unit
Polymers | Number of chains | 8 |
Total formula weight | 249153.9 | |
Non-Polymers* | Number of molecules | 23 |
Total formula weight | 9260.2 | |
All* | Total formula weight | 258414.1 |