2024-08-03_00000225
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medium
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8W2D
holo-PCP-Thioesterase di-domain structure from the sulfazecin biosynthetic nonribosomal peptide synthetase, SulM;
X-ray diffraction 2.70Å
Protein #1
345 residues (93% resolved)
Raw Sequence ...
GSSHHHHHHSSGLVPRGSHMERLTEIFRGVLGHAAFGIRDDFFDLGGDSFKAIRIAAKYGPPLEVTDIYDHPTIEALAEHLEHASEESSSIVLMAGDPATAKAVVVCVANAAGGPVNFVDMSRAMPEQASDVAMFGVKLPRTEVDSDGAMLEEVRRLSNAVCDDLLAATDLPAIVFAQANGSALALAITRELVRRSADVRALCIGGALMRTVTGKRDTRTDDEILAFLGKAGSTLPAQPDEQAFFLHDFRYDGWLADVYYNHLVDLMSRGALEVVDIPVWCLVGSEDPLVPNYPVRFQDWSHIGRPVQLVEYAGIGHYLLRDCPEAIARAVGSVWEHVSCKGVTA
Canonical Sequence ...
GSSHHHHHHSSGLVPRGSHMERLTEIFRGVLGHAAFGIRDDFFDLGGDSFKAIRIAAKYGPPLEVTDIYDHPTIEALAEHLEHASEESSSIVLMAGDPATAKAVVVCVANAAGGPVNFVDMSRAMPEQASDVAMFGVKLPRTEVDSDGAMLEEVRRLSNAVCDDLLAATDLPAIVFAQANGSALALAITRELVRRSADVRALCIGGALMRTVTGKRDTRTDDEILAFLGKAGSTLPAQPDEQAFFLHDFRYDGWLADVYYNHLVDLMSRGALEVVDIPVWCLVGSEDPLVPNYPVRFQDWSHIGRPVQLVEYAGIGHYLLRDCPEAIARAVGSVWEHVSCKGVTA
Non polymer #2
EDO
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
SMILES: C(CO)O
C(CO)O
Non polymer #3
PNS
InChI=1S/C11H23N2O7PS/c1-11(2,7-20-21(17,18)19)9(15)10(16)13-4-3-8(14)12-5-6-22/h9,15,22H,3-7H2,1-2H3,(H,12,14)(H,13,16)(H2,17,18,19)/t9-/m0/s1
InChI=1S/C11H23N2O7PS/c1-11(2,7-20-21(17,18)19)9(15)10(16)13-4-3-8(14)12-5-6-22/h9,15,22H,3-7H2,1-2H3,(H,12,14)(H,13,16)(H2,17,18,19)/t9-/m0/s1
SMILES: CC(C)(COP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCS)O
CC(C)(COP(=O)(O)O)[C@H](C(=O)NCCC(=O)NCCS)O
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
100%