PDB entry 4hld

View 4hld on RCSB PDB site
Description: Sulfonylpiperidines as Novel, Antibacterial Inhibitors of Gram-Positive Thymidylate Kinase (TMK): Compound 11
Class: transferase/transferase inhibitor
Keywords: TMK, kinase, thymidylate kinase, MRSA, pipiridine, transferase-transferase inhibitor complex
Deposited on 2012-10-16, released 2012-10-31
The last revision prior to the SCOPe 2.07 freeze date was dated 2013-01-02, with a file datestamp of 2012-12-28.
Experiment type: XRAY
Resolution: 2 Å
R-factor: 0.209
AEROSPACI score: 0.42 (click here for full SPACI score report)

Chains and heterogens:

  • Chain 'A':
    Compound: thymidylate kinase
    Species: Staphylococcus aureus subsp. aureus [TaxId:282458]
    Gene: SAR0483, tmk
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.07: d4hlda_
  • Chain 'B':
    Compound: thymidylate kinase
    Species: Staphylococcus aureus subsp. aureus [TaxId:282458]
    Gene: SAR0483, tmk
    Database cross-references and differences (RAF-indexed): Domains in SCOPe 2.07: d4hldb_
  • Heterogens: 16T, HOH

PDB Chain Sequences:

  • Chain 'A':
    Sequence, based on SEQRES records: (download) 
    >4hldA (A:)
msafitfegpegsgkttvinevyhrlvkdydvimtrepggvptgeeirkivlegndmdir
teamlfaasrrehlvlkvipalkegkvvlcdryidsslayqgyargigveevralnefai
nglypdltiylnvsaevgreriiknsrdqnrldqedlkfhekviegyqeiihnesqrfks
vnadqplenvvedtyqtiikyleki

    Sequence, based on observed residues (ATOM records): (download) 
    >4hldA (A:)
safitfegpegsgkttvinevyhrlvkdydvimtrepggvptgeeirkivlegndmdirt
eamlfaasrrehlvlkvipalkegkvvlcdryidsslayqgyargigveevralnefain
glypdltiylnvsaevgreriikndqedlkfhekviegyqeiihnesqrfksvnadqple
nvvedtyqtiikylek

  • Chain 'B':
    Sequence, based on SEQRES records: (download) 
    >4hldB (B:)
msafitfegpegsgkttvinevyhrlvkdydvimtrepggvptgeeirkivlegndmdir
teamlfaasrrehlvlkvipalkegkvvlcdryidsslayqgyargigveevralnefai
nglypdltiylnvsaevgreriiknsrdqnrldqedlkfhekviegyqeiihnesqrfks
vnadqplenvvedtyqtiikyleki

    Sequence, based on observed residues (ATOM records): (download) 
    >4hldB (B:)
safitfegpegsgkttvinevyhrlvkdydvimtrepggvptgeeirkivlegndmdirt
eamlfaasrrehlvlkvipalkegkvvlcdryidsslayqgyargigveevralnefain
glypdltiylnvsaevgreriiknsdqedlkfhekviegyqeiihnesqrfksvnadqpl
envvedtyqtiikyleki