Structure of PDB 6q4y Chain A Binding Site BS02

Receptor Information
>6q4y Chain A (length=317) Species: 929439 (Leishmania mexicana MHOM/GT/2001/U1103) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SHMGLLNTKPCSLIPAKEAFEREKKIYGKAILSFDGVNGYDVYNCSIPFT
YDGKTYIFGRVEKKDEWVHSNSILFEKVGENRYRRHPASITYNLEDPFVV
KIHGEMVFGGTHVTKNGGKVSDYRCEFYHGTPFNLKYFSSGPSKMKDIRL
VELADGKIGIFTHFLTGFTTIDKVEDLTVEVINSAKLINHRPFGDAWGGP
SQVYLLSSGLLGCISHHGYLLDQKDGIQLRIYACTSFVFDPATYEVYNFK
IIGTKGCFPPCEPKLPHLADCAFVSGIEMRNDGKCNLYSGIGDVAEGYIV
IDYPFEGYGKIVSDVAF
Ligand information
Ligand IDMAN
InChIInChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5+,6+/m1/s1
InChIKeyWQZGKKKJIJFFOK-PQMKYFCFSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(O1)O)O)O)O)O
CACTVS 3.341OC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
CACTVS 3.341OC[C@H]1O[C@H](O)[C@@H](O)[C@@H](O)[C@@H]1O
OpenEye OEToolkits 1.5.0C([C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O)O)O)O)O
ACDLabs 10.04OC1C(O)C(OC(O)C1O)CO
FormulaC6 H12 O6
Namealpha-D-mannopyranose;
alpha-D-mannose;
D-mannose;
mannose
ChEMBLCHEMBL365590
DrugBank
ZINCZINC000003860903
PDB chain6q4y Chain A Residue 402 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB6q4y A Family of Dual-Activity Glycosyltransferase-Phosphorylases Mediates Mannogen Turnover and Virulence in Leishmania Parasites.
Resolution1.7 Å
Binding residue
(original residue number in PDB)		L30 S31 D39 V40 V298
Binding residue
(residue number reindexed from 1)		L32 S33 D41 V42 V294
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links