Brand  (β version)

color scheme of protein:

hetatm:

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information
centroid:
interaction residue:

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Ligands
Code Name Link
9TG 3-[(2r)-2-borono-2-{[(thiophen-2-yl)acetyl]amino}ethyl]benzoic acid
Code : 5W12
Header : HYDROLASE/HYDROLASE INHIBITOR
Title : ADC-7 in complex with boronic acid transition state inhibitor EC04
Release Data : 2017-11-29
Compound :
mol_id molecule chains
1 Beta-lactamase A,B,C,D
ec: 3.5.2.6
Source :
mol_id organism_scientific expression_system
1 Acinetobacter baumannii  (taxid:470) Escherichia coli  (taxid:469008)
expression_system_strain: BL21(DE3)
expression_system_vector_type: Plasmid
expression_system_plasmid: pET28a
Authors : Smolen, K.A., Powers, R.A., Wallar, B.J.
Keywords : inhibitor, Beta-lactamase, BATSI, EC04, HYDROLASE-HYDROLASE INHIBITOR complex
Exp. method : X-RAY DIFFRACTION ( 1.88 Å )
Citation :

Inhibition of Acinetobacter-Derived Cephalosporinase: Exploring the Carboxylate Recognition Site Using Novel beta-Lactamase Inhibitors.

Caselli, E.,Romagnoli, C.,Powers, R.A.  et al.
(2018)  ACS Infect Dis  4 : 337 - 348

PubMed: 29144725
DOI: 10.1021/acsinfecdis.7b00153

Chain : A, B, C, D
UniProt : Q6DRA1 (No found in current UniProtKB/SwissProt)
Reaction : -