Structure of PDB 6dps Chain F Binding Site BS02

Receptor Information
>6dps Chain F (length=120) Species: 662598 (Neisseria meningitidis alpha14) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DLLPPEKAFVPELAVADDGVNVRFRIADGYYMYQAKIVGKTDPADLLGQP
SFSKGEEKEDEFFGRQTVYHHEAQVAFPYAKAVGEPYKLVLTYQGCAEVG
VCYPPVDTEFDISGNGTYHP
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain6dps Chain F Residue 204 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6dps Structural and biochemical insights into the disulfide reductase mechanism of DsbD, an essential enzyme for neisserial pathogens.
Resolution2.556 Å
Binding residue
(original residue number in PDB)		E14 H121
Binding residue
(residue number reindexed from 1)		E12 H119
Annotation score1
Enzymatic activity
Enzyme Commision number 1.8.1.8: protein-disulfide reductase.
External links