Structure of PDB 7dwa Chain A Binding Site BS02

Receptor Information
>7dwa Chain A (length=314) Species: 122631 (Bacillus sp. N16-5) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MDYIKGMTWGWIGNSEDWRSNEAERSMEEMTNLAINWTAIAFQGLQETAH
SPDITFAEPPMVTDENVRWAIAKAKSLGLSVILKPIVNVRDGTWRAHINF
FDKDVPCEPTWSQWFKSYESFMLHYAKLAEDTGCEMLCIGCAMVQTERRE
KEWRDLIQKVRQVYSGIITYNCDKYQEDEVTWWDAVDVMSSSGYYPIGSW
EHHESRIKKIVESWQKPFFFMEAGCPSRLESGSVPYDWNKNRGQIDMDEQ
RVFYEEMFKFFHGQKWFYGFMLWDWPAKLYRLEDASENDDYCVYGKPAAE
VIKSFFTSNKIAKR
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 chain7dwa Chain G Residue 2 [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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PDB7dwa Functional and structural investigation of a novel beta-mannanase BaMan113A from Bacillus sp. N16-5.
Resolution1.62 Å
Binding residue
(original residue number in PDB)		W11 W238
Binding residue
(residue number reindexed from 1)		W11 W238
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links