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PDBsum entry 4dds

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protein ligands links
Hydrolase/hydrolase inhibitor PDB id
4dds

 

 

 

 

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Contents
Protein chains
260 a.a.
Ligands
0J7 ×5
DMS
Waters ×493
PDB id:
4dds
Name: Hydrolase/hydrolase inhibitor
Title: Ctx-m-9 class a beta-lactamase complexed with compound 11
Structure: Beta-lactamase. Chain: a, b. Fragment: unp residues 30-291. Synonym: beta-lactamase ctx-m, beta-lactamase ctx-m-9a, betalactamase ctx-m-9, ctx-m-9 beta-lactamase, ctx-m-9 extended-spectrum beta- lactamase. Engineered: yes
Source: Escherichia coli. Organism_taxid: 562. Gene: blactx-m-9, blactx-m-9a, blactx-m-9b, ctx-m. Expressed in: escherichia coli. Expression_system_taxid: 469008.
Resolution:
1.36Å     R-factor:   0.158     R-free:   0.199
Authors: D.A.Nichols,Y.Chen
Key ref: D.A.Nichols et al. (2012). Structure-based design of potent and ligand-efficient inhibitors of CTX-M class A β-lactamase. J Med Chem, 55, 2163-2172. PubMed id: 22296601
Date:
19-Jan-12     Release date:   28-Mar-12    
PROCHECK
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 Headers
 References

Protein chains
Pfam   ArchSchema ?
Q9L5C8  (Q9L5C8_ECOLX) -  Beta-lactamase from Escherichia coli
Seq:
Struc:
291 a.a.
260 a.a.
Key:    PfamA domain  Secondary structure  CATH domain

 Enzyme reactions 
   Enzyme class: E.C.3.5.2.6  - beta-lactamase.
[IntEnz]   [ExPASy]   [KEGG]   [BRENDA]

      Pathway:
Penicillin Biosynthesis and Metabolism
      Reaction: a beta-lactam + H2O = a substituted beta-amino acid
      Cofactor: Zn(2+)

 

 
J Med Chem 55:2163-2172 (2012)
PubMed id: 22296601  
 
 
Structure-based design of potent and ligand-efficient inhibitors of CTX-M class A β-lactamase.
D.A.Nichols, P.Jaishankar, W.Larson, E.Smith, G.Liu, R.Beyrouthy, R.Bonnet, A.R.Renslo, Y.Chen.
 
  ABSTRACT  
 
No abstract given.

 

 

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