PDB entry 5ll9

View 5ll9 on RCSB PDB site
Description: Crystal structure of human carbonic anhydrase isozyme XII with 4-(1H-benzimidazol-1-ylacetyl)-2-chlorobenzenesulfonamide
Class: lyase
Keywords: drug design, carbonic anhydrase, benzenesulfonamide, metal-binding, lyase-lyase inhibitor comple, lyase
Deposited on 2016-07-27, released 2017-08-16
The last revision prior to the SCOPe 2.06 freeze date was dated 2017-08-16, with a file datestamp of 2017-08-11.
Experiment type: XRAY
Resolution: 1.45 Å
R-factor: N/A
AEROSPACI score: 0.5 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Carbonic anhydrase 12
    Species: Homo sapiens [TaxId:9606]
    Gene: CA12
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.06: d5ll9a_
  • Chain 'B':
    Compound: Carbonic anhydrase 12
    Species: Homo sapiens [TaxId:9606]
    Gene: CA12
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.06: d5ll9b_
  • Chain 'C':
    Compound: Carbonic anhydrase 12
    Species: Homo sapiens [TaxId:9606]
    Gene: CA12
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.06: d5ll9c_
  • Chain 'D':
    Compound: Carbonic anhydrase 12
    Species: Homo sapiens [TaxId:9606]
    Gene: CA12
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.06: d5ll9d_
  • Heterogens: ZN, 6YQ, EDO, SO4, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download)
    >5ll9A (A:)
    mskwtyfgpdgenswskkypscggllqspidlhsdilqydasltplefqgynlsankqfl
    ltnnghsvklnlpsdmhiqglqsrysatqlhlhwgnpndphgsehtvsgqhfaaelhivh
    ynsdlypdastasnkseglavlavliemgsfnpsydkifshlqhvkykgqeafvpgfnie
    ellpertaeyyryrgslttppcnptvlwtvfrnpvqisqeqllaletalycthmddpspr
    eminnfrqvqkfderlvytsfsq
    

    Sequence, based on observed residues (ATOM records): (download)
    >5ll9A (A:)
    kwtyfgpdgenswskkypscggllqspidlhsdilqydasltplefqgynlsankqfllt
    nnghsvklnlpsdmhiqglqsrysatqlhlhwgnpndphgsehtvsgqhfaaelhivhyn
    sdlypdastasnkseglavlavliemgsfnpsydkifshlqhvkykgqeafvpgfnieel
    lpertaeyyryrgslttppcnptvlwtvfrnpvqisqeqllaletalycthmddpsprem
    innfrqvqkfderlvytsfsq
    

  • Chain 'B':
    Sequence, based on SEQRES records: (download)
    >5ll9B (B:)
    mskwtyfgpdgenswskkypscggllqspidlhsdilqydasltplefqgynlsankqfl
    ltnnghsvklnlpsdmhiqglqsrysatqlhlhwgnpndphgsehtvsgqhfaaelhivh
    ynsdlypdastasnkseglavlavliemgsfnpsydkifshlqhvkykgqeafvpgfnie
    ellpertaeyyryrgslttppcnptvlwtvfrnpvqisqeqllaletalycthmddpspr
    eminnfrqvqkfderlvytsfsq
    

    Sequence, based on observed residues (ATOM records): (download)
    >5ll9B (B:)
    kwtyfgpdgenswskkypscggllqspidlhsdilqydasltplefqgynlsankqfllt
    nnghsvklnlpsdmhiqglqsrysatqlhlhwgnpndphgsehtvsgqhfaaelhivhyn
    sdlypdastasnkseglavlavliemgsfnpsydkifshlqhvkykgqeafvpgfnieel
    lpertaeyyryrgslttppcnptvlwtvfrnpvqisqeqllaletalycthmddpsprem
    innfrqvqkfderlvytsfsq
    

  • Chain 'C':
    Sequence, based on SEQRES records: (download)
    >5ll9C (C:)
    mskwtyfgpdgenswskkypscggllqspidlhsdilqydasltplefqgynlsankqfl
    ltnnghsvklnlpsdmhiqglqsrysatqlhlhwgnpndphgsehtvsgqhfaaelhivh
    ynsdlypdastasnkseglavlavliemgsfnpsydkifshlqhvkykgqeafvpgfnie
    ellpertaeyyryrgslttppcnptvlwtvfrnpvqisqeqllaletalycthmddpspr
    eminnfrqvqkfderlvytsfsq
    

    Sequence, based on observed residues (ATOM records): (download)
    >5ll9C (C:)
    kwtyfgpdgenswskkypscggllqspidlhsdilqydasltplefqgynlsankqfllt
    nnghsvklnlpsdmhiqglqsrysatqlhlhwgnpndphgsehtvsgqhfaaelhivhyn
    sdlypdastasnkseglavlavliemgsfnpsydkifshlqhvkykgqeafvpgfnieel
    lpertaeyyryrgslttppcnptvlwtvfrnpvqisqeqllaletalycthmddpsprem
    innfrqvqkfderlvytsfsq
    

  • Chain 'D':
    Sequence, based on SEQRES records: (download)
    >5ll9D (D:)
    mskwtyfgpdgenswskkypscggllqspidlhsdilqydasltplefqgynlsankqfl
    ltnnghsvklnlpsdmhiqglqsrysatqlhlhwgnpndphgsehtvsgqhfaaelhivh
    ynsdlypdastasnkseglavlavliemgsfnpsydkifshlqhvkykgqeafvpgfnie
    ellpertaeyyryrgslttppcnptvlwtvfrnpvqisqeqllaletalycthmddpspr
    eminnfrqvqkfderlvytsfsq
    

    Sequence, based on observed residues (ATOM records): (download)
    >5ll9D (D:)
    kwtyfgpdgenswskkypscggllqspidlhsdilqydasltplefqgynlsankqfllt
    nnghsvklnlpsdmhiqglqsrysatqlhlhwgnpndphgsehtvsgqhfaaelhivhyn
    sdlypdastasnkseglavlavliemgsfnpsydkifshlqhvkykgqeafvpgfnieel
    lpertaeyyryrgslttppcnptvlwtvfrnpvqisqeqllaletalycthmddpsprem
    innfrqvqkfderlvytsfsq