Structure of PDB 1mr1 Chain C Binding Site BS01

Receptor Information
>1mr1 Chain C (length=97) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SHMRVYHECFGKCKGLLVPELYSSPSAACIQCLDCRLMYPPHKFVVHSHK
ALENRTCHWGFDSANWRAYILLSQDYTGKEEQARLGRCLDDVKEKFD
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 chain1mr1 Chain C Residue 601 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1mr1 Structural Mechanism of Smad4 Recognition by the Nuclear Oncoprotein Ski: Insights on Ski-mediated Repression of TGF-beta Signaling
Resolution2.85 Å
Binding residue
(original residue number in PDB)		C247 C250 H262 H264
Binding residue
(residue number reindexed from 1)		C32 C35 H47 H49
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology

View graph for
Molecular Function
External links
PDB RCSB:1mr1, PDBe:1mr1, PDBj:1mr1
PDBsum1mr1
PubMed12419246
UniProtP12755|SKI_HUMAN Ski oncogene (Gene Name=SKI)

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