Brand  (β version)

color scheme of protein:

hetatm:

x
information
centroid:
interaction residue:

chain:

Ligands
Code Name Link
CZ8 ({[(2r)-2-{[(4-ethyl-2,3-dioxopiperazin-1-yl)carbonyl]amino}-4-(4-hydroxyphenyl)butanoyl]amino}methyl)boronic acid
MA4 Cyclohexyl-hexyl-beta-D-maltoside
Code : 3MXR
Header : HYDROLASE/HYDROLASE INHIBITOR
Title : SHV-1 beta-lactamase complex with compound 1
Release Data : 2010-11-24
Compound :
mol_id molecule chains synonym
1 Beta-lactamase SHV-1 A PIT-2
ec: 3.5.2.6
Source :
mol_id organism_scientific expression_system
1 Klebsiella pneumoniae  (taxid:573) Escherichia coli  (taxid:562)
gene: bla, shv1
expression_system_strain: DH10B
expression_system_vector_type: PLASMID
expression_system_plasmid: PBC SK(-)
Authors : Ke, W., van den Akker, F.
Keywords : beta-lactamase, boronic acid transition state inhibitor, drug design, HYDROLASE, HYDROLASE-HYDROLASE INHIBITOR complex
Exp. method : X-RAY DIFFRACTION ( 1.30 Å )
Citation :

Novel Insights into the Mode of Inhibition of Class A SHV-1 {beta}-Lactamases Revealed by Boronic Acid Transition State Inhibitors.

Ke, W.,Sampson, J.M.,Ori, C.  et al.
(2011)  Antimicrob.Agents Chemother.  55 : 174 - 183

PubMed: 21041505
DOI: 10.1128/AAC.00930-10

Chain : A
UniProt : P0AD64 (BLA1_KLEPN)
Reaction : A beta-lactam + H(2)O = a substituted beta- amino acid.