Structure of PDB 4yr9 Chain B Binding Site BS02

Receptor Information
>4yr9 Chain B (length=307) Species: 10090 (Mus musculus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PPRVLITGGLGQLGVGLANLLRKRFGKDNVILSDIRKPPAHVFHSGPFVY
ANILDYKSLREIVVNHRISWLFHYSALLSAVGEANVSLARDVNITGLHNV
LDVAAEYNVRLFVPSTIGAFGPTSPRNPAPDLCIQRPRTIYGVSKVHTEL
MGEYYYYRYGLDFRCLRYPGIISADPGGGTTDYAVQIFHAAAKNGTFECN
LEAGTRLPMMYISDCLRATLEVMEAPAERLSMRTYNISAMSFTPEELAQA
LRKHAPDFQITYCVDPLRQAIAESWPMILDDSNARKDWGWKHDFDLPELV
ATMLNFH
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 B 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)		L132 S133 Y195 T236 T237
Binding residue
(residue number reindexed from 1)		L78 S79 Y141 T180 T181
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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