6ZO5
Fusidic acid binding to the TM1/TM2 groove of AcrB-G619P_G621P
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 (A, B, C) | Multidrug efflux pump subunit AcrB | polymer | 1057 | 114816.4 | 3 | UniProt (P31224) Pfam (PF00873) | Escherichia coli K-12 | AcrAB-TolC multidrug efflux pump subunit AcrB,Acridine resistance protein B |
| 2 | D, E (D, E) | DARPIN | polymer | 169 | 18317.6 | 2 | synthetic construct | ||
| 3 | F (A) | 3,6,9,12,15,18,21,24,27-NONAOXANONACOSANE-1,29-DIOL | non-polymer | 458.5 | 1 | Chemie (XPE) | |||
| 4 | G, H, I, J, RA... (A, C, B) | DODECYL-BETA-D-MALTOSIDE | non-polymer | 510.6 | 8 | Chemie (LMT) | |||
| 5 | K, L, SA, Z (A, C, B) | DODECANE | non-polymer | 170.3 | 4 | Chemie (D12) | |||
| 6 | BA, CA, M, N, VA (B, A, C) | DECANE | non-polymer | 142.3 | 5 | Chemie (D10) | |||
| 7 | AB, FA, O, P, Q... (C, B, A) | GLYCEROL | non-polymer | 92.1 | 8 | Chemie (GOL) | |||
| 8 | BB, CB, GA, HA, IA... (C, B, A) | HEXANE | non-polymer | 86.2 | 7 | Chemie (HEX) | |||
| 9 | EB, FB, GB, JA, KA... (C, D, B, A) | 1,2-ETHANEDIOL | non-polymer | 62.1 | 7 | Chemie (EDO) | |||
| 10 | U (B) | (2S)-3-hydroxypropane-1,2-diyl didecanoate | non-polymer | 400.6 | 1 | Chemie (DDR) | |||
| 11 | V (B) | FUSIDIC ACID | non-polymer | 516.7 | 1 | Chemie (FUA) | |||
| 12 | AA, TA, UA (B, C) | TETRADECANE | non-polymer | 198.4 | 3 | Chemie (C14) | |||
| 13 | DA, EA, WA (B, C) | SULFATE ION | non-polymer | 96.1 | 3 | Chemie (SO4) | |||
| 14 | MA, OA (C) | (2S)-3-{[(R)-(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-2-hydroxypropyl hexadecanoate | non-polymer | 453.6 | 2 | Chemie (LPX) | |||
| 15 | NA, PA (C) | TRIETHYLENE GLYCOL | non-polymer | 150.2 | 2 | Chemie (PGE) | |||
| 16 | QA (C) | PHOSPHATIDYLETHANOLAMINE | non-polymer | 734.0 | 1 | Chemie (PTY) | |||
| 17 | DB (C) | N-OCTANE | non-polymer | 114.2 | 1 | Chemie (OCT) | |||
| 18 | HB, IB, JB, KB, LB (A, B, C, D, E) | water | water | 18.0 | 844 | Chemie (HOH) |
Sequence modifications
A, B, C: 1 - 1049 (UniProt: P31224)
| PDB | External Database | Details |
|---|---|---|
| Pro 619 | Gly 619 | engineered mutation |
| Pro 621 | Gly 621 | engineered mutation |
| Leu 1050 | - | expression tag |
| Glu 1051 | - | expression tag |
| His 1052 | - | expression tag |
| His 1053 | - | expression tag |
| His 1054 | - | expression tag |
| His 1055 | - | expression tag |
| His 1056 | - | expression tag |
| His 1057 | - | expression tag |
Sequence viewer
Contents of the asymmetric unit
| Polymers | Number of chains | 5 |
| Total formula weight | 381084.4 | |
| Non-Polymers* | Number of molecules | 54 |
| Total formula weight | 11567.0 | |
| All* | Total formula weight | 392651.4 |
