2024-12-14_00000463
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ligand
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9GOK
X-ray structure of lysozyme obtained upon reaction with the dioxidovanadium(V) complex with (E)-N'-(1-(2-hydroxy-5-methoxyphenyl)ethylidene)furan-2-carbohydrazide);
X-ray diffraction 1.18Å
Protein #1
129 residues (100% resolved)
Raw Sequence ...
KVFGRCELAAAMKRHGLDNYRGYSLGNWVCAAKFESNFNTQATNRNTDGSTDYGILQINSRWWCNDGRTPGSRNLCNIPCSALLSSDITASVNCAKKIVSDGNGMNAWVAWRNRCKGTDVQAWIRGCRL
Canonical Sequence ...
KVFGRCELAAAMKRHGLDNYRGYSLGNWVCAAKFESNFNTQATNRNTDGSTDYGILQINSRWWCNDGRTPGSRNLCNIPCSALLSSDITASVNCAKKIVSDGNGMNAWVAWRNRCKGTDVQAWIRGCRL
Non polymer #2
A1ION
InChI=1S/C14H14N2O4.2O.V/c1-9(11-8-10(19-2)5-6-12(11)17)15-16-14(18)13-4-3-7-20-13;;;/h3-8,17H,1-2H3,(H,16,18);;;/q;;;+2/p-2/b15-9+;;;
InChI=1S/C14H14N2O4.2O.V/c1-9(11-8-10(19-2)5-6-12(11)17)15-16-14(18)13-4-3-7-20-13;;;/h3-8,17H,1-2H3,(H,16,18);;;/q;;;+2/p-2/b15-9+;;;
SMILES: CC1=[N]2N=C(O[V]2(=O)(=O)Oc3c1cc(cc3)OC)c4ccco4
CC1=[N]2N=C(O[V]2(=O)(=O)Oc3c1cc(cc3)OC)c4ccco4
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
CL
InChI=1S/ClH/h1H/p-1
InChI=1S/ClH/h1H/p-1
SMILES: [Cl-]
[Cl-]
Non polymer #5
NA
InChI=1S/Na/q+1
InChI=1S/Na/q+1
SMILES: [Na+]
[Na+]
Biounit #1
monomer
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