Structure of PDB 6q4y Chain A Binding Site BS01

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 IDBMA
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-RWOPYEJCSA-N
SMILES
SoftwareSMILES
CACTVS 3.341OC[C@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1O
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
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
Namebeta-D-mannopyranose;
beta-D-mannose;
D-mannose;
mannose
ChEMBL
DrugBank
ZINCZINC000003830679
PDB chain6q4y Chain A Residue 401 [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)		N42 D94 R234 Y236 L272 F277 D297
Binding residue
(residue number reindexed from 1)		N44 D96 R230 Y232 L268 F273 D293
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links