Structure of PDB 3fg8 Chain C Binding Site BS01

Receptor Information
>3fg8 Chain C (length=105) Species: 101510 (Rhodococcus jostii RHA1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SGRENLYFQGGLGFMALDEDLRIIYVNSGCLRHVRRSRDELLGRVVTEVL
PETQGSYFDALCRKVLATGREQQTRVDSLYSPGMTIEVTAAADSGALVVH
FRDVT
Ligand information
Ligand ID3PB
InChIInChI=1S/C4H9O6P/c1-3(2-4(5)6)10-11(7,8)9/h3H,2H2,1H3,(H,5,6)(H2,7,8,9)/t3-/m1/s1
InChIKeyCEWUUYVGYVJSGW-GSVOUGTGSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0CC(CC(=O)O)OP(=O)(O)O
CACTVS 3.341C[C@H](CC(O)=O)O[P](O)(O)=O
ACDLabs 10.04O=P(O)(O)OC(CC(=O)O)C
CACTVS 3.341C[CH](CC(O)=O)O[P](O)(O)=O
OpenEye OEToolkits 1.5.0C[C@H](CC(=O)O)OP(=O)(O)O
FormulaC4 H9 O6 P
Name(3R)-3-(phosphonooxy)butanoic acid
ChEMBL
DrugBank
ZINCZINC000058638456
PDB chain3fg8 Chain C Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3fg8 Crystal structure of PAS domain of RHA05790
Resolution1.8 Å
Binding residue
(original residue number in PDB)		H150 Y174 S195 L196 Y197 I203
Binding residue
(residue number reindexed from 1)		H33 Y57 S78 L79 Y80 I86
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links