Structure of PDB 6uab Chain A Binding Site BS02

Receptor Information
>6uab Chain A (length=155) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SDELYRQSLEIISRYLREQATGAKDTKPMGRSGATSRKALETLRRVGDGV
QRNHETAFQGMLRKLDIKNEDDVKSLSRVMIHVFSDGVTNWGRIVTLISF
GAFVAKHLKTINQESCIEPLAESITDVLVRTKRDWLVKQRGWDGFVEFFH
VEDLE
Ligand information
Ligand IDADM
InChIInChI=1S/C10H16/c1-7-2-9-4-8(1)5-10(3-7)6-9/h7-10H,1-6H2/t7-,8+,9-,10+
InChIKeyORILYTVJVMAKLC-YNFQOJQRSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0		C1C2CC3CC1CC(C2)C3
FormulaC10 H16
NameADAMANTANE
ChEMBL
DrugBankDB03627
ZINC
PDB chain6uab Chain B Residue 101 [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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PDB6uab Inhibitor peptides against Mcl-1 containing non-natural amino acids show potent apoptotic response.
Resolution2.1 Å
Binding residue
(original residue number in PDB)		M231 V253
Binding residue
(residue number reindexed from 1)		M61 V83
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0042981 regulation of apoptotic process

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Biological Process
External links
PDB RCSB:6uab, PDBe:6uab, PDBj:6uab
PDBsum6uab
PubMed
UniProtQ07820|MCL1_HUMAN Induced myeloid leukemia cell differentiation protein Mcl-1 (Gene Name=MCL1)

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