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MolNFT v2 · #167490 · protein

X-ray co-crystal structure of compound 8 bound to human Mcl-1

6UDU: “X-ray co-crystal structure of compound 8 bound to human Mcl-1”. X-ray diffraction at 1.75, 1 ligand (Q4Y). MolNFT v2 #167490 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6UDU
Type
protein
Length
156 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
1.75
Source
Homo sapiens
UniProt
Q07820
Ligands
Q4Y

Structure

x-ray diffraction · resolution 1.75 · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein156—Q07820

Ligands and binding sites

  • Q4Y · (4S,11E,17R)-6'-chloro-17-hydroxy-14-methyl-15-oxo-3', 4',8,9,10,13,14,15,16,17-decahydro-2'H,3H,5H,7H-spiro[1,18-(ethanediylidene)[1,4]oxazepino[4,3-A][1, 8]diazacyclopentadecine-4,1'-naphthalene]-17-carboxylic acid · ligand · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Compared structures

  • 6UDU · X-ray co-crystal structure of compound 8 bound to human mcl-1 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q07820 · AlphaFold monomer V2.0 prediction for induced myeloid leukemia cell differentiation… · a predicted model of the same protein · chain A against A, TM-score 0.95

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