PDB entry 5a5z

View 5a5z on RCSB PDB site
Description: Approved Drugs Containing Thiols as Inhibitors of Metallo-beta- lactamases: Strategy To Combat Multidrug-Resistant Bacteria
Class: hydrolase
Keywords: hydrolase, metallo-beta-lactamase, ndm-1, new delhi metallo- beta-lactamase 1, tiopronin
Deposited on 2015-06-23, released 2015-07-08
The last revision prior to the SCOPe 2.07 freeze date was dated 2015-07-08, with a file datestamp of 2015-07-02.
Experiment type: XRAY
Resolution: 2.6 Å
R-factor: N/A
AEROSPACI score: 0.2 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Beta-lactamase NDM-1
    Species: Klebsiella pneumoniae [TaxId:573]
    Database cross-references and differences (RAF-indexed):
    • Uniprot C7C422 (Start-242)
      • expression tag (243-244)
    Domains in SCOPe 2.07: d5a5za1, d5a5za2
  • Chain 'C':
    Compound: Beta-lactamase NDM-1
    Species: Klebsiella pneumoniae [TaxId:573]
    Database cross-references and differences (RAF-indexed):
    • Uniprot C7C422 (Start-242)
      • expression tag (243-244)
    Domains in SCOPe 2.07: d5a5zc1, d5a5zc2
  • Heterogens: ZN, WJZ, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >5a5zA (A:)
mgeirptigqqmetgdqrfgdlvfrqlapnvwqhtsyldmpgfgavasnglivrdggrvl
vvdtawtddqtaqilnwikqeinlpvalavvthahqdkmggmdalhaagiatyanalsnq
lapqegmvaaqhsltfaangwvepatapnfgplkvfypgpghtsdnitvgidgtdiafgg
clikdskakslgnlgdadtehyaasarafgaafpkasmivmshsapdsraaithtarmad
klrlehhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >5a5zA (A:)
qqmetgdqrfgdlvfrqlapnvwqhtsyldmpgfgavasnglivrdggrvlvvdtawtdd
qtaqilnwikqeinlpvalavvthahqdkmggmdalhaagiatyanalsnqlapqegmva
aqhsltfaangwvepatapnfgplkvfypgpghtsdnitvgidgtdiafggclikdskak
slgnlgdadtehyaasarafgaafpkasmivmshsapdsraaithtarmadklrle

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >5a5zC (C:)
mgeirptigqqmetgdqrfgdlvfrqlapnvwqhtsyldmpgfgavasnglivrdggrvl
vvdtawtddqtaqilnwikqeinlpvalavvthahqdkmggmdalhaagiatyanalsnq
lapqegmvaaqhsltfaangwvepatapnfgplkvfypgpghtsdnitvgidgtdiafgg
clikdskakslgnlgdadtehyaasarafgaafpkasmivmshsapdsraaithtarmad
klrlehhhhhh

    Sequence, based on observed residues (ATOM records): (download) 
    >5a5zC (C:)
qqmetgdqrfgdlvfrqlapnvwqhtsyldmpgfgavasnglivrdggrvlvvdtawtdd
qtaqilnwikqeinlpvalavvthahqdkmggmdalhaagiatyanalsnqlapqegmva
aqhsltfaangwvepatapnfgplkvfypgpghtsdnitvgidgtdiafggclikdskak
slgnlgdadtehyaasarafgaafpkasmivmshsapdsraaithtarmadklrle