2025-09-06_00000229
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ligand
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9Q3H
GspB Siglec domain bound to sialyl T antigen linked to serine-FMOC;
X-ray diffraction 1.89Å
Protein #1
127 residues (98% resolved)
Raw Sequence ...
GPGSDTERPVVNVPSEITVYRGESFEYFATVTDNSNAFDLAKTVVRWLYSNQPGRGTEWLQYSVTQVGNQLKVRIFGNVPIDTTIGDYTRYVVATDAAGNVNATQTEMGNAAVDKTSVNGQFKLIIR
Canonical Sequence ...
GPGSDTERPVVNVPSEITVYRGESFEYFATVTDNSNAFDLAKTVVRWLYSNQPGRGTEWLQYSVTQVGNQLKVRIFGNVPIDTTIGDYTRYVVATDAAGNVNATQTEMGNAAVDKTSVNGQFKLIIR
Non polymer #2
CA
InChI=1S/Ca/q+2
InChI=1S/Ca/q+2
SMILES: [Ca+2]
[Ca+2]
Non polymer #3
SER
InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1
InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1
SMILES: C([C@@H](C(=O)O)N)O
C([C@@H](C(=O)O)N)O
Non polymer #4
VP1
InChI=1S/C15H11ClO2/c16-15(17)18-9-14-12-7-3-1-5-10(12)11-6-2-4-8-13(11)14/h1-8,14H,9H2
InChI=1S/C15H11ClO2/c16-15(17)18-9-14-12-7-3-1-5-10(12)11-6-2-4-8-13(11)14/h1-8,14H,9H2
SMILES: c1ccc2c(c1)-c3ccccc3C2COC(=O)Cl
c1ccc2c(c1)-c3ccccc3C2COC(=O)Cl
Biounit #1
hetero-2-2-mer
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Model
Reference
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