2025-02-22_00000366
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ligand
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9DZC
PvRBP2b N-terminal domain stabilised mutant WHT2483;
X-ray diffraction 2.40Å
Protein #1
330 residues (92% resolved)
Raw Sequence ...
MSYYHHHHHHDYDIPTTENLYFQGAMGSTNTTDNIDYFDISDESNYYLISQLRPHFSNIYFFDEFKRYASYHTEIKRYEDIHKTKVNSLLNEASRAIGICNRLKNTLKGLINILENPQKFKTQRESYDVLLRQYEEKKEAFRGCLLNKNRKNLDQIKKINNEIRDLLEKLKCSQDCQTNVYWDMIKIYLVDFKKMPLENYDTFIKQFKNSYLSYVDLIRKIEKQIDDPITLNAIKFVLKEMGYIIDRFEYHLQKVKHAIDQVTALADGVKPKQVTKNELKEYYFNIGNYYAIFKFAKDQLNMLNKALIHKEKIVHNLLGELFGHLEERIS
Canonical Sequence ...
MSYYHHHHHHDYDIPTTENLYFQGAMGSTNTTDNIDYFDISDESNYYLISQLRPHFSNIYFFDEFKRYASYHTEIKRYEDIHKTKVNSLLNEASRAIGICNRLKNTLKGLINILENPQKFKTQRESYDVLLRQYEEKKEAFRGCLLNKNRKNLDQIKKINNEIRDLLEKLKCSQDCQTNVYWDMIKIYLVDFKKMPLENYDTFIKQFKNSYLSYVDLIRKIEKQIDDPITLNAIKFVLKEMGYIIDRFEYHLQKVKHAIDQVTALADGVKPKQVTKNELKEYYFNIGNYYAIFKFAKDQLNMLNKALIHKEKIVHNLLGELFGHLEERIS
Non polymer #2
EPE
InChI=1S/C8H18N2O4S/c11-7-5-9-1-3-10(4-2-9)6-8-15(12,13)14/h11H,1-8H2,(H,12,13,14)
InChI=1S/C8H18N2O4S/c11-7-5-9-1-3-10(4-2-9)6-8-15(12,13)14/h11H,1-8H2,(H,12,13,14)
SMILES: C1CN(CCN1CCO)CCS(=O)(=O)O
C1CN(CCN1CCO)CCS(=O)(=O)O
Non polymer #3
MPD
InChI=1S/C6H14O2/c1-5(7)4-6(2,3)8/h5,7-8H,4H2,1-3H3/t5-/m0/s1
InChI=1S/C6H14O2/c1-5(7)4-6(2,3)8/h5,7-8H,4H2,1-3H3/t5-/m0/s1
SMILES: C[C@@H](CC(C)(C)O)O
C[C@@H](CC(C)(C)O)O
Non polymer #4
PEG
InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2
InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2
SMILES: C(COCCO)O
C(COCCO)O
Biounit #1
homo-dimer
Download coordinates
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Model
Reference
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