PDB entry 4e2f

View 4e2f on RCSB PDB site
Description: Crystal Structure of E. coli Aspartate Transcarbamoylase K164E/E239K Mutant in an intermediate state
Class: transferase/protein binding
Keywords: transferase, cooperativity, allosteric transition, intermediate, TRANSFERASE-PROTEIN BINDING complex
Deposited on 2012-03-08, released 2012-05-02
The last revision prior to the SCOPe 2.08 freeze date was dated 2012-05-30, with a file datestamp of 2012-05-25.
Experiment type: XRAY
Resolution: 2.8 Å
R-factor: 0.217
AEROSPACI score: 0.26 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Aspartate carbamoyltransferase catalytic chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4245, JW4204, pyrB
    Database cross-references and differences (RAF-indexed):
    • Uniprot P0A786 (0-309)
      • engineered mutation (163)
      • engineered mutation (238)
    Domains in SCOPe 2.08: d4e2fa1, d4e2fa2
  • Chain 'B':
    Compound: Aspartate carbamoyltransferase regulatory chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4244, JW4203, pyrI
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d4e2fb1, d4e2fb2
  • Chain 'C':
    Compound: Aspartate carbamoyltransferase catalytic chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4245, JW4204, pyrB
    Database cross-references and differences (RAF-indexed):
    • Uniprot P0A786 (0-309)
      • engineered mutation (163)
      • engineered mutation (238)
    Domains in SCOPe 2.08: d4e2fc1, d4e2fc2
  • Chain 'D':
    Compound: Aspartate carbamoyltransferase regulatory chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4244, JW4203, pyrI
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d4e2fd1, d4e2fd2
  • Chain 'E':
    Compound: Aspartate carbamoyltransferase catalytic chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4245, JW4204, pyrB
    Database cross-references and differences (RAF-indexed):
    • Uniprot P0A786 (0-309)
      • engineered mutation (163)
      • engineered mutation (238)
    Domains in SCOPe 2.08: d4e2fe1, d4e2fe2
  • Chain 'F':
    Compound: Aspartate carbamoyltransferase regulatory chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4244, JW4203, pyrI
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d4e2ff1, d4e2ff2
  • Chain 'G':
    Compound: Aspartate carbamoyltransferase catalytic chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4245, JW4204, pyrB
    Database cross-references and differences (RAF-indexed):
    • Uniprot P0A786 (0-309)
      • engineered mutation (163)
      • engineered mutation (238)
    Domains in SCOPe 2.08: d4e2fg1, d4e2fg2
  • Chain 'H':
    Compound: Aspartate carbamoyltransferase regulatory chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4244, JW4203, pyrI
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d4e2fh1, d4e2fh2
  • Chain 'I':
    Compound: Aspartate carbamoyltransferase catalytic chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4245, JW4204, pyrB
    Database cross-references and differences (RAF-indexed):
    • Uniprot P0A786 (0-309)
      • engineered mutation (163)
      • engineered mutation (238)
    Domains in SCOPe 2.08: d4e2fi1, d4e2fi2
  • Chain 'J':
    Compound: Aspartate carbamoyltransferase regulatory chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4244, JW4203, pyrI
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d4e2fj1, d4e2fj2
  • Chain 'K':
    Compound: Aspartate carbamoyltransferase catalytic chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4245, JW4204, pyrB
    Database cross-references and differences (RAF-indexed):
    • Uniprot P0A786 (0-309)
      • engineered mutation (163)
      • engineered mutation (238)
    Domains in SCOPe 2.08: d4e2fk1, d4e2fk2
  • Chain 'L':
    Compound: Aspartate carbamoyltransferase regulatory chain
    Species: Escherichia coli [TaxId:83333]
    Gene: b4244, JW4203, pyrI
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.08: d4e2fl1, d4e2fl2
  • Heterogens: ZN, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence; same for both SEQRES and ATOM records: (download) 
    >4e2fA (A:)
anplyqkhiisindlsrddlnlvlataaklkanpqpellkhkviascffeastrtrlsfe
tsmhrlgasvvgfsdsantslgkkgetladtisvistyvdaivmrhpqegaarlatefsg
nvpvlnagdgsnqhptqtlldlftiqetqgrldnlhvamvgdleygrtvhsltqalakfd
gnrfyfiapdalampqyildmldekgiawslhssieevmaevdilymtrvqkerldpsky
anvkaqfvlrasdlhnakanmkvlhplprvdeiatdvdktphawyfqqagngifarqall
alvlnrdlvl

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >4e2fB (B:)
mthdnklqveaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlik
ientflsedqvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaep
vsssfavrkrandialkckycekefshnvvlan

    Sequence, based on observed residues (ATOM records): (download) 
    >4e2fB (B:)
eaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlikientflsed
qvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaepvsssfavrk
randialkckycekefshnvvlan

  • Chain 'C':
    Sequence; same for both SEQRES and ATOM records: (download) 
    >4e2fC (C:)
anplyqkhiisindlsrddlnlvlataaklkanpqpellkhkviascffeastrtrlsfe
tsmhrlgasvvgfsdsantslgkkgetladtisvistyvdaivmrhpqegaarlatefsg
nvpvlnagdgsnqhptqtlldlftiqetqgrldnlhvamvgdleygrtvhsltqalakfd
gnrfyfiapdalampqyildmldekgiawslhssieevmaevdilymtrvqkerldpsky
anvkaqfvlrasdlhnakanmkvlhplprvdeiatdvdktphawyfqqagngifarqall
alvlnrdlvl

  • Chain 'D':
    Sequence, based on SEQRES records: (download) 
    >4e2fD (D:)
mthdnklqveaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlik
ientflsedqvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaep
vsssfavrkrandialkckycekefshnvvlan

    Sequence, based on observed residues (ATOM records): (download) 
    >4e2fD (D:)
eaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlikientflsed
qvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaepvsssfavrk
randialkckycekefshnvvlan

  • Chain 'E':
    Sequence; same for both SEQRES and ATOM records: (download) 
    >4e2fE (E:)
anplyqkhiisindlsrddlnlvlataaklkanpqpellkhkviascffeastrtrlsfe
tsmhrlgasvvgfsdsantslgkkgetladtisvistyvdaivmrhpqegaarlatefsg
nvpvlnagdgsnqhptqtlldlftiqetqgrldnlhvamvgdleygrtvhsltqalakfd
gnrfyfiapdalampqyildmldekgiawslhssieevmaevdilymtrvqkerldpsky
anvkaqfvlrasdlhnakanmkvlhplprvdeiatdvdktphawyfqqagngifarqall
alvlnrdlvl

  • Chain 'F':
    Sequence, based on SEQRES records: (download) 
    >4e2fF (F:)
mthdnklqveaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlik
ientflsedqvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaep
vsssfavrkrandialkckycekefshnvvlan

    Sequence, based on observed residues (ATOM records): (download) 
    >4e2fF (F:)
eaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlikientflsed
qvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaepvsssfavrk
randialkckycekefshnvvlan

  • Chain 'G':
    Sequence; same for both SEQRES and ATOM records: (download) 
    >4e2fG (G:)
anplyqkhiisindlsrddlnlvlataaklkanpqpellkhkviascffeastrtrlsfe
tsmhrlgasvvgfsdsantslgkkgetladtisvistyvdaivmrhpqegaarlatefsg
nvpvlnagdgsnqhptqtlldlftiqetqgrldnlhvamvgdleygrtvhsltqalakfd
gnrfyfiapdalampqyildmldekgiawslhssieevmaevdilymtrvqkerldpsky
anvkaqfvlrasdlhnakanmkvlhplprvdeiatdvdktphawyfqqagngifarqall
alvlnrdlvl

  • Chain 'H':
    Sequence, based on SEQRES records: (download) 
    >4e2fH (H:)
mthdnklqveaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlik
ientflsedqvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaep
vsssfavrkrandialkckycekefshnvvlan

    Sequence, based on observed residues (ATOM records): (download) 
    >4e2fH (H:)
eaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlikientflsed
qvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaepvsssfavrk
randialkckycekefshnvvlan

  • Chain 'I':
    Sequence; same for both SEQRES and ATOM records: (download) 
    >4e2fI (I:)
anplyqkhiisindlsrddlnlvlataaklkanpqpellkhkviascffeastrtrlsfe
tsmhrlgasvvgfsdsantslgkkgetladtisvistyvdaivmrhpqegaarlatefsg
nvpvlnagdgsnqhptqtlldlftiqetqgrldnlhvamvgdleygrtvhsltqalakfd
gnrfyfiapdalampqyildmldekgiawslhssieevmaevdilymtrvqkerldpsky
anvkaqfvlrasdlhnakanmkvlhplprvdeiatdvdktphawyfqqagngifarqall
alvlnrdlvl

  • Chain 'J':
    Sequence, based on SEQRES records: (download) 
    >4e2fJ (J:)
mthdnklqveaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlik
ientflsedqvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaep
vsssfavrkrandialkckycekefshnvvlan

    Sequence, based on observed residues (ATOM records): (download) 
    >4e2fJ (J:)
eaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlikientflsed
qvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaepvsssfavrk
randialkckycekefshnvvlan

  • Chain 'K':
    Sequence; same for both SEQRES and ATOM records: (download) 
    >4e2fK (K:)
anplyqkhiisindlsrddlnlvlataaklkanpqpellkhkviascffeastrtrlsfe
tsmhrlgasvvgfsdsantslgkkgetladtisvistyvdaivmrhpqegaarlatefsg
nvpvlnagdgsnqhptqtlldlftiqetqgrldnlhvamvgdleygrtvhsltqalakfd
gnrfyfiapdalampqyildmldekgiawslhssieevmaevdilymtrvqkerldpsky
anvkaqfvlrasdlhnakanmkvlhplprvdeiatdvdktphawyfqqagngifarqall
alvlnrdlvl

  • Chain 'L':
    Sequence, based on SEQRES records: (download) 
    >4e2fL (L:)
mthdnklqveaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlik
ientflsedqvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaep
vsssfavrkrandialkckycekefshnvvlan

    Sequence, based on observed residues (ATOM records): (download) 
    >4e2fL (L:)
eaikrgtvidhipaqigfkllslfkltetdqritiglnlpsgemgrkdlikientflsed
qvdqlalyapqatvnridnyevvgksrpslperidnvlvcpnsncishaepvsssfavrk
randialkckycekefshnvvlan