Structure of PDB 7tvp Chain A Binding Site BS03

Receptor Information
>7tvp Chain A (length=225) Species: 12908 (unclassified sequences) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HMSELSEIDSVAGVTIYSVDGEPKSFVYKAGFAIDADGAPNAYAPNNGGT
DFTANGGDDQGGDWWGGPVDAEGYPIKQKIFDPFPGYYVSATAHFNPAYS
EDSPYRYIDSNSIPFIVLPGNHSNGAKLGDVALVYNEKTGDNCYAIYGDV
GPSSKIGQGSVRLAQALKIDDNPKAGGTESRIVVTLVFPGSVGKWETPKR
WFSHANQLTKAWGGLSRLKTLSDQL
Ligand information
Ligand IDGCS
InChIInChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4-,5-,6-/m1/s1
InChIKeyMSWZFWKMSRAUBD-QZABAPFNSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O)N)O)O)O
CACTVS 3.341N[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(O1)O)N)O)O)O
CACTVS 3.341N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O
ACDLabs 10.04OC1C(O)C(OC(O)C1N)CO
FormulaC6 H13 N O5
Name2-amino-2-deoxy-beta-D-glucopyranose;
beta-D-glucosamine;
2-amino-2-deoxy-beta-D-glucose;
2-amino-2-deoxy-D-glucose;
2-amino-2-deoxy-glucose;
D-GLUCOSAMINE
ChEMBLCHEMBL234432
DrugBank
ZINCZINC000003860468
PDB chain7tvp Chain B Residue 3 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7tvp Structural characterization of a soil viral auxiliary metabolic gene product - a functional chitosanase.
Resolution1.3 Å
Binding residue
(original residue number in PDB)
T91 Y106
Binding residue
(residue number reindexed from 1)
T92 Y107
Annotation score4
External links