Single particle cryo-EM co-structure of E. coli AcrB with bound BDM91531 inhibitor at 3.23 A resolution
Boernsen, C., Mueller, R.T.To be published.
Experimental Data Snapshot
wwPDB Validation   3D Report Full Report
Entity ID: 1 | |||||
---|---|---|---|---|---|
Molecule | Chains | Sequence Length | Organism | Details | Image |
Multidrug efflux pump subunit AcrB | 1,049 | Escherichia coli K-12 | Mutation(s): 0  Gene Names: acrB Membrane Entity: Yes  | ||
UniProt | |||||
Find proteins for P31224 (Escherichia coli (strain K12)) Explore P31224  Go to UniProtKB:  P31224 | |||||
Entity Groups   | |||||
Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
UniProt Group | P31224 | ||||
Sequence AnnotationsExpand | |||||
|
Ligands 2 Unique | |||||
---|---|---|---|---|---|
ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
WR6 Query on WR6 | E [auth B] | [(2~{R})-1-[[(2~{R})-2,3-bis(oxidanyl)propoxy]-oxidanyl-phosphoryl]oxy-3-undecanoyloxy-propan-2-yl] tricosanoate C40 H79 O10 P QVTMHGKJALUQCM-XPSQVAKYSA-N | |||
XE9 (Subject of Investigation/LOI) Query on XE9 | D [auth A] | [3-(3-chloranyl-2-piperazin-1-yl-quinolin-6-yl)phenyl]methanamine C20 H21 Cl N4 PMBAQAZUQBDHLD-UHFFFAOYSA-N |
Task | Software Package | Version |
---|---|---|
RECONSTRUCTION | cryoSPARC | 4 |
Funding Organization | Location | Grant Number |
---|---|---|
German Federal Ministry for Education and Research | Germany | BMBF- 16GW0236K |
Agence Nationale de la Recherche (ANR) | France | ANR-19-AMRB-0007 |