PDB entry 3o82

View 3o82 on RCSB PDB site
Description: Structure of BasE N-terminal domain from Acinetobacter baumannii bound to 5'-O-[N-(2,3-dihydroxybenzoyl)sulfamoyl] adenosine
Class: ligase
Keywords: Ligase, Adenylation of 2,3-dihydroxybenzoate and transfer to pantetheine cofactor of BasF, Non-Ribosomal Peptide Synthetase (NRPS)
Deposited on 2010-08-02, released 2010-10-06
The last revision prior to the SCOPe 2.04 freeze date was dated 2010-11-10, with a file datestamp of 2010-11-05.
Experiment type: XRAY
Resolution: 2.7 Å
R-factor: 0.203
AEROSPACI score: 0.28 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Peptide arylation enzyme
    Species: Acinetobacter baumannii [TaxId:557601]
    Gene: ACICU_02578, basE
    Database cross-references and differences (RAF-indexed):
    • Uniprot B2HVG8
      • engineered mutation (46)
      • see remark 999 (69)
      • see remark 999 (150)
      • see remark 999 (181)
      • see remark 999 (227)
      • see remark 999 (330)
      • see remark 999 (379)
    Domains in SCOPe 2.04: d3o82a_
  • Chain 'B':
    Compound: Peptide arylation enzyme
    Species: Acinetobacter baumannii [TaxId:557601]
    Gene: ACICU_02578, basE
    Database cross-references and differences (RAF-indexed):
    • Uniprot B2HVG8
      • engineered mutation (46)
      • see remark 999 (69)
      • see remark 999 (150)
      • see remark 999 (181)
      • see remark 999 (227)
      • see remark 999 (330)
      • see remark 999 (379)
    Domains in SCOPe 2.04: d3o82b_
  • Heterogens: HP8, CA, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >3o82A (A:)
ghmkkqliefvrwsperaqhyrnkgywidqpltriltvgvqshphslaiicgerqlsyie
ldrlstnlatrlaekglgkgdtalvqlpnvaefyivffallkagvvvlnalyshrqyeln
afikqiqpklligsrqhevfsnnqfidslhdvnlspeiilmlnhqatdfglldwietpae
tfvdfsstpadevaffqlsggstgtpkliprthndydysvrasaeicglnsntrllcalp
aphnfmlsspgalgvlhaggcvvmapnpeplncfsiiqrhqvnmaslvpsavimwlekaa
qykdqiqslkllqvggasfpeslarqvpevlncklqqvfgmaeglvnytrlddsdeqift
tqgrpissddeikivdeqyrevpegeigmlatrgpytfcgyyqspehnsqvfdednyyys
gdlvqrtpdgnlrvvgrikdqinrggekiaseeieklillhpevmhaalvaivdeqfgek
scafivsrnpelkavvlrrhlmelgiaqyklpdqiklieslpltavgkvdkkqlrsilnt
stts

    Sequence, based on observed residues (ATOM records): (download) 
    >3o82A (A:)
kqliefvrwsperaqhyrnkgywidqpltriltvgvqshphslaiicgerqlsyieldrl
stnlatrlaekglgkgdtalvqlpnvaefyivffallkagvvvlnalyshrqyelnafik
qiqpklligsrqhevfsnnqfidslhdvnlspeiilmlnhqatdfglldwietpaetfvd
fsstpadevaffqlsggstgtpkliprthndydysvrasaeicglnsntrllcalpaphn
fmlsspgalgvlhaggcvvmapnpeplncfsiiqrhqvnmaslvpsavimwlekaaqykd
qiqslkllqvggasfpeslarqvpevlncklqqvfgmaeglvnytrlddsdeqifttqgr
pissddeikivdeqyrevpegeigmlatrgpytfcgyyqspehnsqvfdednyyysgdlv
qrtpdgnlrvvgrik

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >3o82B (B:)
ghmkkqliefvrwsperaqhyrnkgywidqpltriltvgvqshphslaiicgerqlsyie
ldrlstnlatrlaekglgkgdtalvqlpnvaefyivffallkagvvvlnalyshrqyeln
afikqiqpklligsrqhevfsnnqfidslhdvnlspeiilmlnhqatdfglldwietpae
tfvdfsstpadevaffqlsggstgtpkliprthndydysvrasaeicglnsntrllcalp
aphnfmlsspgalgvlhaggcvvmapnpeplncfsiiqrhqvnmaslvpsavimwlekaa
qykdqiqslkllqvggasfpeslarqvpevlncklqqvfgmaeglvnytrlddsdeqift
tqgrpissddeikivdeqyrevpegeigmlatrgpytfcgyyqspehnsqvfdednyyys
gdlvqrtpdgnlrvvgrikdqinrggekiaseeieklillhpevmhaalvaivdeqfgek
scafivsrnpelkavvlrrhlmelgiaqyklpdqiklieslpltavgkvdkkqlrsilnt
stts

    Sequence, based on observed residues (ATOM records): (download) 
    >3o82B (B:)
qliefvrwsperaqhyrnkgywidqpltriltvgvqshphslaiicgerqlsyieldrls
tnlatrlaekglgkgdtalvqlpnvaefyivffallkagvvvlnalyshrqyelnafikq
iqpklligsrqhevfsnnqfidslhdvnlspeiilmlnhqatdfglldwietpaetfvdf
sstpadevaffqlsggstgtpkliprthndydysvrasaeicglnsntrllcalpaphnf
mlsspgalgvlhaggcvvmapnpeplncfsiiqrhqvnmaslvpsavimwlekaaqykdq
iqslkllqvggasfpeslarqvpevlncklqqvfgmaeglvnytrlddsdeqifttqgrp
issddeikivdeqyrevpegeigmlatrgpytfcgyyqspehnsqvfdednyyysgdlvq
rtpdgnlrvvgrikd