2024-09-21_00000119
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ligand
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8WFO
Durio zibethinus trypsin inhibitor DzTI-4;
X-ray diffraction 1.55Å
Protein #1
194 residues (98% resolved)
Raw Sequence ...
KNEPVLDTDGDELRAGEQYYVVSAIWGAGGGGLALGRLTDQKCPEIVVQRRSDLDYGTPVVFYNLDTKDDIVRRSTDLNIQFVPIRDRLCLTSTVWKIDDYDTSTGKWWVTTDGVIGNPSPQTLQSWFKIEKSGNLGYKFNFCPSVCESCVTLCNDIGRYGHDGQIRLALGENAWPFVFKKASSTIKQVVNAKN
Canonical Sequence ...
KNEPVLDTDGDELRAGEQYYVVSAIWGAGGGGLALGRLTDQKCPEIVVQRRSDLDYGTPVVFYNLDTKDDIVRRSTDLNIQFVPIRDRLCLTSTVWKIDDYDTSTGKWWVTTDGVIGNPSPQTLQSWFKIEKSGNLGYKFNFCPSVCESCVTLCNDIGRYGHDGQIRLALGENAWPFVFKKASSTIKQVVNAKN
Non polymer #2
1PE
InChI=1S/C10H22O6/c11-1-3-13-5-7-15-9-10-16-8-6-14-4-2-12/h11-12H,1-10H2
InChI=1S/C10H22O6/c11-1-3-13-5-7-15-9-10-16-8-6-14-4-2-12/h11-12H,1-10H2
SMILES: C(COCCOCCOCCOCCO)O
C(COCCOCCOCCOCCO)O
Non polymer #3
ACT
InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1
InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1
SMILES: CC(=O)[O-]
CC(=O)[O-]
Non polymer #4
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
homo-dimer
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Model
Reference
100%