PDB entry 5wae

View 5wae on RCSB PDB site
Description: ADC-7 in complex with boronic acid transition state inhibitor CR167
Class: hydrolase/hydrolase inhibitor
Keywords: inhibitor, Beta-lactamase, BATSI, ADC-7, ANTIMICROBIAL PROTEIN, HYDROLASE-HYDROLASE INHIBITOR complex
Deposited on 2017-06-26, released 2017-12-06
The last revision prior to the SCOPe 2.08 freeze date was dated 2019-12-11, with a file datestamp of 2019-12-06.
Experiment type: XRAY
Resolution: 1.8 Å
R-factor: N/A
AEROSPACI score: 0.37 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Beta-lactamase
    Species: ACINETOBACTER BAUMANNII [TaxId:470]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d5waea_
  • Chain 'B':
    Compound: Beta-lactamase
    Species: ACINETOBACTER BAUMANNII [TaxId:470]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d5waeb_
  • Chain 'C':
    Compound: Beta-lactamase
    Species: ACINETOBACTER BAUMANNII [TaxId:470]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d5waec_
  • Chain 'D':
    Compound: Beta-lactamase
    Species: ACINETOBACTER BAUMANNII [TaxId:470]
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d5waed_
  • Heterogens: A1J, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >5waeA (A:)
mdntpkdqeikklvdqnfkpllekydvpgmavgviqnnkkyemyyglqsvqdkkavnsnt
ifelgsvsklftataggyaknkgkisfddtpgkywkelkntpidqvnllqlatytsgnla
lqfpdevqtdqqvltffkdwkpknpigeyrqysnpsiglfgkvvalsmnkpfdqvlekti
fpalglkhsyvnvpktqmqnyafgynqenqpirvnpgpldapaygvkstlpdmlsfihan
lnpqkyptdiqrainethqgryqvntmyqalgweefsypatlqtlldsnseqivmkpnkv
taiskepsvkmyhktgstsgfgtyvvfipkeniglvmltnkripneerikaayvvlnaik
k

    Sequence, based on observed residues (ATOM records): (download) 
    >5waeA (A:)
kdqeikklvdqnfkpllekydvpgmavgviqnnkkyemyyglqsvqdkkavnsntifelg
svsklftataggyaknkgkisfddtpgkywkelkntpidqvnllqlatytsgnlalqfpd
evqtdqqvltffkdwkpknpigeyrqysnpsiglfgkvvalsmnkpfdqvlektifpalg
lkhsyvnvpktqmqnyafgynqenqpirvnpgpldapaygvkstlpdmlsfihanlnpqk
yptdiqrainethqgryqvntmyqalgweefsypatlqtlldsnseqivmkpnkvtaisk
epsvkmyhktgstsgfgtyvvfipkeniglvmltnkripneerikaayvvlnaik

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >5waeB (B:)
mdntpkdqeikklvdqnfkpllekydvpgmavgviqnnkkyemyyglqsvqdkkavnsnt
ifelgsvsklftataggyaknkgkisfddtpgkywkelkntpidqvnllqlatytsgnla
lqfpdevqtdqqvltffkdwkpknpigeyrqysnpsiglfgkvvalsmnkpfdqvlekti
fpalglkhsyvnvpktqmqnyafgynqenqpirvnpgpldapaygvkstlpdmlsfihan
lnpqkyptdiqrainethqgryqvntmyqalgweefsypatlqtlldsnseqivmkpnkv
taiskepsvkmyhktgstsgfgtyvvfipkeniglvmltnkripneerikaayvvlnaik
k

    Sequence, based on observed residues (ATOM records): (download) 
    >5waeB (B:)
ntpkdqeikklvdqnfkpllekydvpgmavgviqnnkkyemyyglqsvqdkkavnsntif
elgsvsklftataggyaknkgkisfddtpgkywkelkntpidqvnllqlatytsgnlalq
fpdevqtdqqvltffkdwkpknpigeyrqysnpsiglfgkvvalsmnkpfdqvlektifp
alglkhsyvnvpktqmqnyafgynqenqpirvnpgpldapaygvkstlpdmlsfihanln
pqkyptdiqrainethqgryqvntmyqalgweefsypatlqtlldsnseqivmkpnkvta
iskepsvkmyhktgstsgfgtyvvfipkeniglvmltnkripneerikaayvvlnaik

  • Chain 'C':
    Sequence, based on SEQRES records: (download) 
    >5waeC (C:)
mdntpkdqeikklvdqnfkpllekydvpgmavgviqnnkkyemyyglqsvqdkkavnsnt
ifelgsvsklftataggyaknkgkisfddtpgkywkelkntpidqvnllqlatytsgnla
lqfpdevqtdqqvltffkdwkpknpigeyrqysnpsiglfgkvvalsmnkpfdqvlekti
fpalglkhsyvnvpktqmqnyafgynqenqpirvnpgpldapaygvkstlpdmlsfihan
lnpqkyptdiqrainethqgryqvntmyqalgweefsypatlqtlldsnseqivmkpnkv
taiskepsvkmyhktgstsgfgtyvvfipkeniglvmltnkripneerikaayvvlnaik
k

    Sequence, based on observed residues (ATOM records): (download) 
    >5waeC (C:)
pkdqeikklvdqnfkpllekydvpgmavgviqnnkkyemyyglqsvqdkkavnsntifel
gsvsklftataggyaknkgkisfddtpgkywkelkntpidqvnllqlatytsgnlalqfp
devqtdqqvltffkdwkpknpigeyrqysnpsiglfgkvvalsmnkpfdqvlektifpal
glkhsyvnvpktqmqnyafgynqenqpirvnpgpldapaygvkstlpdmlsfihanlnpq
kyptdiqrainethqgryqvntmyqalgweefsypatlqtlldsnseqivmkpnkvtais
kepsvkmyhktgstsgfgtyvvfipkeniglvmltnkripneerikaayvvlnaik

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >5waeD (D:)
mdntpkdqeikklvdqnfkpllekydvpgmavgviqnnkkyemyyglqsvqdkkavnsnt
ifelgsvsklftataggyaknkgkisfddtpgkywkelkntpidqvnllqlatytsgnla
lqfpdevqtdqqvltffkdwkpknpigeyrqysnpsiglfgkvvalsmnkpfdqvlekti
fpalglkhsyvnvpktqmqnyafgynqenqpirvnpgpldapaygvkstlpdmlsfihan
lnpqkyptdiqrainethqgryqvntmyqalgweefsypatlqtlldsnseqivmkpnkv
taiskepsvkmyhktgstsgfgtyvvfipkeniglvmltnkripneerikaayvvlnaik
k

    Sequence, based on observed residues (ATOM records): (download) 
    >5waeD (D:)
dqeikklvdqnfkpllekydvpgmavgviqnnkkyemyyglqsvqdkkavnsntifelgs
vsklftataggyaknkgkisfddtpgkywkelkntpidqvnllqlatytsgnlalqfpde
vqtdqqvltffkdwkpknpigeyrqysnpsiglfgkvvalsmnkpfdqvlektifpalgl
khsyvnvpktqmqnyafgynqenqpirvnpgpldapaygvkstlpdmlsfihanlnpqky
ptdiqrainethqgryqvntmyqalgweefsypatlqtlldsnseqivmkpnkvtaisep
svkmyhktgstsgfgtyvvfipkeniglvmltnkripneerikaayvvlnaik