PDB entry 3uwk
View 3uwk on RCSB PDB site
Description: Structure Guided Development of Novel Thymidine Mimetics targeting Pseudomonas aeruginosa Thymidylate Kinase: from Hit to Lead Generation
Class: transferase/transferase inhibitor
Keywords: Thymidylate kinase, kinase, thymidine triphosphate, TRANSFERASE-TRANSFERASE INHIBITOR complex
Deposited on
2011-12-02, released
2012-02-01
The last revision prior to the SCOPe 2.05 freeze date was dated
2012-11-14, with a file datestamp of
2012-11-09.
Experiment type: XRAY
Resolution: 1.91 Å
R-factor: 0.197
AEROSPACI score: 0.47
(click here for full SPACI score report)
Chains and heterogens:
- Chain 'A':
Compound: thymidylate kinase
Species: Pseudomonas aeruginosa [TaxId:208964]
Gene: PA2962, tmk
Database cross-references and differences (RAF-indexed):
Domains in SCOPe 2.05: d3uwka_ - Chain 'B':
Compound: thymidylate kinase
Species: Pseudomonas aeruginosa [TaxId:208964]
Gene: PA2962, tmk
Database cross-references and differences (RAF-indexed):
Domains in SCOPe 2.05: d3uwkb_ - Heterogens: 0DF, MG, HOH
PDB Chain Sequences:
- Chain 'A':
Sequence, based on SEQRES records: (download)
>3uwkA (A:)
mgsshhhhhhssglvprgshmtglfvtlegpegagkstnrdylaerlrergievqltrep
ggtplaerirelllapsdepmaadtelllmfaaraqhlagvirpalargavvlcdrftda
tyayqgggrglpeariaalesfvqgdlrpdltlvfdlpveiglaraaargrldrfeqedr
rffeavrqtylqraaqaperyqvldaglplaevqagldrllpnllerlnggs
Sequence, based on observed residues (ATOM records): (download)
>3uwkA (A:)
glfvtlegpegagkstnrdylaerlrergievqltrepggtplaerirelllapsdepma
adtelllmfaaraqhlagvirpalargavvlcdrftdatyayqgggrglpeariaalesf
vqgdlrpdltlvfdlpveiglaraaardrfeqedrrffeavrqtylqraaqaperyqvld
aglplaevqagldrllpnller
- Chain 'B':
Sequence, based on SEQRES records: (download)
>3uwkB (B:)
mgsshhhhhhssglvprgshmtglfvtlegpegagkstnrdylaerlrergievqltrep
ggtplaerirelllapsdepmaadtelllmfaaraqhlagvirpalargavvlcdrftda
tyayqgggrglpeariaalesfvqgdlrpdltlvfdlpveiglaraaargrldrfeqedr
rffeavrqtylqraaqaperyqvldaglplaevqagldrllpnllerlnggs
Sequence, based on observed residues (ATOM records): (download)
>3uwkB (B:)
glfvtlegpegagkstnrdylaerlrergievqltrepggtplaerirelllapsdepma
adtelllmfaaraqhlagvirpalargavvlcdrftdatyayqgggrglpeariaalesf
vqgdlrpdltlvfdlpveigdrfeqedrrffeavrqtylqraaqaperyqvldaglplae
vqagldrllpnllerl