PDB entry 4cd3

View 4cd3 on RCSB PDB site
Description: RnNTPDase2 X4 variant in complex with PSB-071
Class: hydrolase
Keywords: hydrolase, apyrase, ATPase, purinergic signalling, drug design, inhibitor, ntpdase
Deposited on 2013-10-29, released 2014-02-12
The last revision prior to the SCOPe 2.05 freeze date was dated 2014-03-12, with a file datestamp of 2014-03-07.
Experiment type: XRAY
Resolution: 2.19 Å
R-factor: 0.18202
AEROSPACI score: 0.33 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: Ectonucleoside triphosphate diphosphohydrolase 2
    Species: Rattus norvegicus [TaxId:10116]
    Database cross-references and differences (RAF-indexed):
    • Uniprot O35795 (Start-455)
      • variant (121-122)
      • engineered mutation (147)
      • engineered mutation (420)
    Domains in SCOPe 2.05: d4cd3a1, d4cd3a2
  • Heterogens: 8E9, GOL, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download)
    >4cd3A (A:)
    mahhhhhhvgtgsnddddkspdptqdvreppalkygivldagsshtsmfvykwpadkend
    tgivgqhsscdvqgggissyandpskagqslvrcleqalrdvprdrhastplylgatagm
    rllnltspeatarvleavtqtltqypfefrgarilsgqdegvfgwvtanyllenfikygw
    vgrwirprkgtlgamdlggastqitfettspsedpgnevhlrlygqhyrvythsflcygr
    dqillrllasalqihrfhpcwpkgystqvllqevyqspctmgqrprafngsaivslsgts
    natlcrdlvsrlfnisscpfsqcsfngvfqppvagnfiafsafyytvdflttvmglpvgt
    lkqleeateitcnqtwtelqarvpgqktrladycavamfihqllsrgyhfdersfrevvf
    skkaadtavgwalgymlnltnlipadlpglrkgthf
    

    Sequence, based on observed residues (ATOM records): (download)
    >4cd3A (A:)
    palkygivldagsshtsmfvykwpadkendtgivgqhsscdvqgggissyandpskagqs
    lvrcleqalrdvprdrhastplylgatagmrllnltspeatarvleavtqtltqypfefr
    garilsgqdegvfgwvtanyllenfikygwvgrwirprkgtlgamdlggastqitfetts
    psedpgnevhlrlygqhyrvythsflcygrdqillrllasalqihrfhpcwpkgystqvl
    lqevyqspctmgqrpsaivslsgtsnatlcrdlvsrlfnisscpfsqcsfngvfqppvag
    nfiafsafyytvdflttvmglpvgtlkqleeateitcnqtwtelqarvpgqktrladyca
    vamfihqllsrgyhfdersfrevvfskkaadtavgwalgymlnltnlipadlpglrkgth
    f