UniProt P31224
Multidrug efflux pump subunit AcrB (P31224)
Multidrug efflux pump subunit AcrB (UniProt P31224): 179 experimental structures and 1 predicted model on GenesisL1, 39 ligands bound, 499 pockets. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- P31224
- Protein
- Multidrug efflux pump subunit AcrB
- Experimental structures
- 179
- Predicted models
- 1
- Ligands
- 39
- Pockets
- 499 · 26 records with a druggable one
Structures
180 records of P31224 in the MolNFT archive: 179 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 1IWG | Crystal structure of Bacterial Multidrug Efflux transporter AcrB | x-ray diffraction | A | — | — |
| 1IWG | Crystal structure of bacterial multidrug efflux transporter acrb | x-ray diffraction | A | — | — |
| 1OY6 | Structural Basis of the Multiple Binding Capacity of the AcrB Multidrug Efflux Pump | x-ray diffraction | A | — | — |
| 1OY6 | Structural basis of the multiple binding capacity of the acrb multidrug efflux pump | x-ray diffraction | A | — | — |
| 1OY8 | Structural Basis of Multiple Drug Binding Capacity of the AcrB Multidrug Efflux Pump | x-ray diffraction | A | — | — |
| 1OY8 | Structural basis of multiple drug binding capacity of the acrb multidrug efflux pump | x-ray diffraction | A | — | — |
| 1OY9 | Structural Basis of Multiple Drug Binding Capacity of the AcrB Multidrug Efflux Pump | x-ray diffraction | A | — | — |
| 1OY9 | Structural basis of multiple drug binding capacity of the acrb multidrug efflux pump | x-ray diffraction | A | — | — |
| 1OYD | Structural Basis of Multiple Binding Capacity of the AcrB multidrug Efflux Pump | x-ray diffraction | A | — | — |
| 1OYD | Structural basis of multiple binding capacity of the acrb multidrug efflux pump | x-ray diffraction | A | — | — |
| 1OYE | Structural Basis of Multiple Binding Capacity of the AcrB multidrug Efflux Pump | x-ray diffraction | A | — | — |
| 1OYE | Structural basis of multiple binding capacity of the acrb multidrug efflux pump | x-ray diffraction | A | — | — |
| 1T9T | Structural Basis of Multidrug transport by the AcrB Multidrug Efflux Pump | x-ray diffraction | A | — | — |
| 1T9T | Structural basis of multidrug transport by the acrb multidrug efflux pump | x-ray diffraction | A | — | — |
| 1T9U | Structural Basis of Multidrug Transport by the AcrB Multidrug Efflux Pump | x-ray diffraction | A | — | — |
| 1T9U | Structural basis of multidrug transport by the acrb multidrug efflux pump | x-ray diffraction | A | — | — |
| 1T9V | Structural Basis of Multidrug Transport by the AcrB Multidrug Efflux Pump | x-ray diffraction | A | — | — |
| 1T9V | Structural basis of multidrug transport by the acrb multidrug efflux pump | x-ray diffraction | A | — | — |
| 1T9W | Structural Basis of Multidrug Transport by the AcrB Multidrug Efflux Pump | x-ray diffraction | A | — | — |
| 1T9W | Structural basis of multidrug transport by the acrb multidrug efflux pump | x-ray diffraction | A | — | — |
| 1T9X | Structural Basis of Multidrug Transport by the AcrB Multidrug Efflux Pump | x-ray diffraction | A | — | — |
| 1T9X | Structural basis of multidrug transport by the acrb multidrug efflux pump | x-ray diffraction | A | — | — |
| 1T9Y | Structural Basis of Multidrug Transport by the AcrB Multidrug Efflux Pump | x-ray diffraction | A | — | — |
| 1T9Y | Structural basis of multidrug transport by the acrb multidrug efflux pump | x-ray diffraction | A | — | — |
| 2DHH | Crystal structure of a multidrug transporter reveal a functionally rotating mechanism | x-ray diffraction | A, B, C | — | — |
| 2DHH | Crystal structure of a multidrug transporter reveal a functionally rotating mechanism | x-ray diffraction | A, B, C | — | — |
| 2DR6 | Crystal structure of a multidrug transporter reveal a functionally rotating mechanism | x-ray diffraction | A, B, C | — | — |
| 2DR6 | Crystal structure of a multidrug transporter reveal a functionally rotating mechanism | x-ray diffraction | A, B, C | — | — |
| 2DRD | Crystal structure of a multidrug transporter reveal a functionally rotating mechanism | x-ray diffraction | A, B, C | — | — |
| 2DRD | Crystal structure of a multidrug transporter reveal a functionally rotating mechanism | x-ray diffraction | A, B, C | — | — |
| 2GIF | Asymmetric structure of trimeric AcrB from Escherichia coli | x-ray diffraction | A, B, C | — | — |
| 2GIF | Asymmetric structure of trimeric acrb from escherichia COLI | x-ray diffraction | A, B, C | — | — |
| 2HQC | Conformation of the AcrB Multidrug Efflux Pump in Mutants of the Putative Proton Relay Pathway | x-ray diffraction | A | — | — |
| 2HQC | Conformation of the acrb multidrug efflux pump in mutants of the putative proton relay pathway | x-ray diffraction | A | — | — |
| 2HQD | Conformation of the AcrB Multidrug Efflux Pump in Mutants of the Putative Proton Relay Pathway | x-ray diffraction | A | — | — |
| 2HQD | Conformation of the acrb multidrug efflux pump in mutants of the putative proton relay pathway | x-ray diffraction | A | — | — |
| 2HQF | Conformation of the AcrB Multidrug Efflux Pump in Mutants of the Putative Proton Relay Pathway | x-ray diffraction | A | — | — |
| 2HQF | Conformation of the acrb multidrug efflux pump in mutants of the putative proton relay pathway | x-ray diffraction | A | — | — |
| 2HQG | Conformation of the AcrB Multidrug Efflux Pump in Mutants of the Putative Proton Relay Pathway | x-ray diffraction | A | — | — |
| 2HQG | Conformation of the acrb multidrug efflux pump in mutants of the putative proton relay pathway | x-ray diffraction | A | — | — |
| 2HRT | Asymmetric structure of trimeric AcrB from Escherichia coli | x-ray diffraction | A, B, C, D, E, F | — | — |
| 2HRT | Asymmetric structure of trimeric acrb from escherichia COLI | x-ray diffraction | A, B, C, D, E, F | — | — |
| 2I6W | Crystal structure of the multidrug efflux transporter AcrB | x-ray diffraction | A | — | — |
| 2I6W | Crystal structure of the multidrug efflux transporter acrb | x-ray diffraction | A | — | — |
| 2J8S | Drug Export Pathway of Multidrug Exporter AcrB Revealed by DARPin Inhibitors | x-ray diffraction | A, B, C | — | — |
| 2J8S | Drug export pathway of multidrug exporter acrb revealed by darpin inhibitors | x-ray diffraction | A, B, C | — | — |
| 2RDD | X-ray crystal structure of AcrB in complex with a novel transmembrane helix. | x-ray diffraction | A | — | — |
| 2RDD | X-ray crystal structure of acrb in complex with a novel transmembrane helix. | x-ray diffraction | A | — | — |
| 2W1B | The structure of the efflux pump AcrB in complex with bile acid | x-ray diffraction | A | — | — |
| 2W1B | The structure of the efflux pump acrb in complex with bile acid | x-ray diffraction | A | — | — |
| 3AOA | Structures of the multidrug exporter AcrB reveal a proximal multisite drug-binding pocket | x-ray diffraction | A, B, C | — | — |
| 3AOA | Structures of the multidrug exporter acrb reveal a proximal multisite drug-binding pocket | x-ray diffraction | A, B, C | — | — |
| 3AOB | Structures of the multidrug exporter AcrB reveal a proximal multisite drug-binding pocket | x-ray diffraction | A, B, C | — | — |
| 3AOB | Structures of the multidrug exporter acrb reveal a proximal multisite drug-binding pocket | x-ray diffraction | A, B, C | — | — |
| 3AOC | Structures of the multidrug exporter AcrB reveal a proximal multisite drug-binding pocket | x-ray diffraction | A, B, C | — | — |
| 3AOC | Structures of the multidrug exporter acrb reveal a proximal multisite drug-binding pocket | x-ray diffraction | A, B, C | — | — |
| 3AOD | Structures of the multidrug exporter AcrB reveal a proximal multisite drug-binding pocket | x-ray diffraction | A, B, C | — | — |
| 3AOD | Structures of the multidrug exporter acrb reveal a proximal multisite drug-binding pocket | x-ray diffraction | A, B, C | — | — |
| 3D9B | Symmetric structure of E. coli AcrB | x-ray diffraction | A | — | — |
| 3D9B | Symmetric structure of E. COLI acrb | x-ray diffraction | A | — | — |
120 records more on the page itself.
Ligands
- D12 · Dodecane · in 33 records
- PTY · Phosphatidylethanolamine · in 31 records
- D10 · Decane · in 29 records
- DDQ · Decylamine-N,N-dimethyl-N-oxide · in 23 records
- SO4 · Sulfate ion · in 23 records
- DDR · (2S)-3-hydroxypropane-1,2-diyl didecanoate · in 17 records
- C14 · Tetradecane · in 16 records
- CL · Chloride ion · in 11 records
- FUA · Fusidic acid · in 11 records
- LPX · (2S)-3-{[(R)-(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-2-hydroxypropyl hexadecanoate · in 9 records
- 3YI · (2S,12Z,14E,16S,17S,18R,19R,20R,21S,22R,23S,24E)-8-formyl-5,6,9,17,19-pentahydroxy-23-methoxy-2,4,12,16, 18,20,22-heptamethyl-1,11-dioxo-1,2-dihydro-2,7-(epoxypentadeca[1,11,13]trienoimino)naphtho[2,1-b]furan-21-yl acetate · in 7 records
- MIY · (4s,4as,5ar,12as)-4,7-bis(dimethylamino)-3,10,12,12A-tetrahydroxy-1,11-dioxo-1,4,4A,5,5A,6,11,12A-octahydrotetracene-2-carboxamide · in 6 records
- 8K6 · Octadecane · in 5 records
- R16 · Hexadecane · in 5 records
- ETE · 2-{2-[2-2-(methoxy-ethoxy)-ethoxy]-ethoxy}-ethanol · in 4 records
- MYS · Pentadecane · in 4 records
- 5QF · 6-[2-(3,4-dimethoxyphenyl)ethylsulfanyl]-8-[4-(2-methoxyethyl)piperazin-1-yl]-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile · in 3 records
- NA · Sodium ion · in 3 records
- 1K8 · 3-chloranyl-2-piperazin-1-yl-quinoline · in 2 records
- 3PE · 1,2-diacyl-sn-glycero-3-phosphoethanolamine · in 2 records
- DXT · (4s,4ar,5s,5ar,6r,12as)-4-(dimethylamino)-3,5,10,12,12A-pentahydroxy-6-methyl-1,11-dioxo-1,4,4A,5,5A,6,11,12A-octahydrotetracene-2-carboxamide · in 2 records
- ERY · Erythromycin A · in 2 records
- LNK · Pentane · in 2 records
- 1KE · 1-(3-chloranyl-5-iodanyl-pyridin-2-yl)piperazine · in 1 record
- 5QE · ~{N}-[4-[2-[[5-cyano-8-[(2~{S},6~{R})-2,6-dimethylmorpholin-4-yl]-3,3-dimethyl-1,4-dihydropyrano[3,4-c]pyridin-6-yl]sulfanyl]ethyl]phenyl]ethanamide · in 1 record
- 5QG · 3,3-dimethyl-8-morpholin-4-yl-6-(2-phenylethylsulfanyl)-1,4-dihydropyrano[3,4-c]pyridine-5-carbonitrile · in 1 record
- A1AN8 · (2S)-1-[(3R)-3-aminopyrrolidin-1-yl]-3-(3,4-dichlorophenoxy)propan-2-ol · in 1 record
- A1AOE · (2R)-1-(4-aminopiperidin-1-yl)-3-[3-(trifluoromethyl)phenoxy]propan-2-ol · in 1 record
- A1AOF · (2S)-1-{[(1R,5R)-3-azabicyclo[3.1.0]hexan-6-yl]amino}-3-(3,5-dichlorophenoxy)propan-2-ol · in 1 record
- A1AON · (2S)-1-(3,4-dichlorophenoxy)-3-(4-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}piperidin-1-yl)propan-2-ol · in 1 record
Experiment against prediction
- 7RR6 chain C against the predicted model P31224: TM-score 0.99, RMSD 1.06 Å
- 9BFM chain C against the predicted model P31224: TM-score 0.99, RMSD 1.10 Å
- 9BFN chain C against the predicted model P31224: TM-score 0.99, RMSD 1.11 Å
- 7RR7 chain C against the predicted model P31224: TM-score 0.99, RMSD 1.10 Å
- 7RR7 chain C against the predicted model P31224: TM-score 0.99, RMSD 1.10 Å
- 9BFH chain C against the predicted model P31224: TM-score 0.99, RMSD 1.11 Å
- 6Q4O chain C against the predicted model P31224: TM-score 0.99, RMSD 1.13 Å
- 6Q4O chain C against the predicted model P31224: TM-score 0.99, RMSD 1.13 Å
- 5JMN chain C against the predicted model P31224: TM-score 0.99, RMSD 1.13 Å
- 5JMN chain C against the predicted model P31224: TM-score 0.99, RMSD 1.13 Å
Elsewhere
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