Structure of PDB 4yr9 Chain A Binding Site BS02

Receptor Information
>4yr9 Chain A (length=308) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PPRVLITGGLGQLGVGLANLLRKRFGKDNVILSDIRKPPAHVFHSGPFVY
ANILDYKSLREIVVNHRISWLFHYSALLSAVGEANVSLARDVNITGLHNV
LDVAAEYNVRLFVPSTIGAFGPTSPRNPAPDLCIQRPRTIYGVSKVHTEL
MGEYYYYRYGLDFRCLRYPGIISADSPGGGTTDYAVQIFHAAAKNGTFEC
NLEAGTRLPMMYISDCLRATLEVMEAPAERLSMRTYNISAMSFTPEELAQ
ALRKHAPDFQITYCVDPLRQAIAESWPMILDDSNARKDWGWKHDFDLPEL
VATMLNFH
Ligand information
Ligand IDGOL
InChIInChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2
InChIKeyPEDCQBHIVMGVHV-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.7.0C(C(CO)O)O
ACDLabs 12.01
CACTVS 3.370		OCC(O)CO
FormulaC3 H8 O3
NameGLYCEROL;
GLYCERIN;
PROPANE-1,2,3-TRIOL
ChEMBLCHEMBL692
DrugBankDB09462
ZINCZINC000000895048
PDB chain4yr9 Chain A Residue 1002 [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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PDB4yr9 Structural insights on mouse l-threonine dehydrogenase: A regulatory role of Arg180 in catalysis
Resolution2.8 Å
Binding residue
(original residue number in PDB)		Y195 T237 W331
Binding residue
(residue number reindexed from 1)		Y141 T182 W276
Annotation score1
Enzymatic activity
Enzyme Commision number 1.1.1.103: L-threonine 3-dehydrogenase.
External links
PDB RCSB:4yr9, PDBe:4yr9, PDBj:4yr9
PDBsum4yr9
PubMed26492815
UniProtQ8K3F7|TDH_MOUSE L-threonine 3-dehydrogenase, mitochondrial (Gene Name=Tdh)

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