Structure of PDB 7caf Chain E Binding Site BS01

Receptor Information
>7caf Chain E (length=443) Species: 246196 (Mycolicibacterium smegmatis MC2 155) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
CGSQTGGIVINYYTPANEEATFKAVANRCNEQLGGRFQIAQRNLPKGADD
QRLQLARRLTGNDKSLDVMALDVVWTAEFAEAGWAVPLSEDPAGLAEADA
TENTLPGPLETARWQDELYAAPITTNTQLLWYRADLMPAPPTTWDGMLDE
ANRLYREGGPSWIAVQGKQYEGMVVWFNTLLQSAGGQVLSDDGQRVTLTD
TPEHRAATVKALRIIKSVATAPGADPSITQTDENTARLALEQGKAALEVN
WPYVLPSLLENAVKGGVSFLPLDGDPALQGSINDVGTFSPTDEQFDIAFD
ASKKVFGFAPYPGVNPDEPARVTLGGLNLAVASTSQHKAEAFEAIRCLRN
VENQRYTSIEGGLPAVRTSLYDDPAFQKKYPQYEIIRQQLTNAAVRPATP
VYQAVSTRMSATLAPISDIDPERTADELTEAVQKAIDGKGLIP
Ligand information
Ligand IDGLC
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-DVKNGEFBSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(O1)O)O)O)O)O
OpenEye OEToolkits 1.5.0C([C@@H]1[C@H]([C@@H]([C@H]([C@H](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
ACDLabs 10.04OC1C(O)C(OC(O)C1O)CO
FormulaC6 H12 O6
Namealpha-D-glucopyranose;
alpha-D-glucose;
D-glucose;
glucose
ChEMBLCHEMBL423707
DrugBank
ZINCZINC000003861213
PDB chain7caf Chain F Residue 1 [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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PDB7caf Structural basis of trehalose recycling by the ABC transporter LpqY-SugABC.
Resolution3.3 Å
Binding residue
(original residue number in PDB)
D94 G194 E255 W273 R418
Binding residue
(residue number reindexed from 1)
D72 G172 E233 W251 R396
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links