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MolNFT v1 · #83127 · protein

Crystal structure of CCM3 in complex with the C-terminal regulatory domain of MST4

3W8I · Programmed cell death protein 10: “Crystal structure of CCM3 in complex with the C-terminal regulatory domain of MST4”. X-ray diffraction, 1 pocket (best druggability 0.39). MolNFT v1 #83127 on GenesisL1: 3D structure, binding sites…

PDB
3W8I
Type
protein
Length
251 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Programmed cell death protein 10; SERINE/THREONINE-protein kinase MST4
EC
2.7.11.1
UniProt
Q9BUL8, Q9P289
Pockets
1 · best druggability 0.39

Structure

x-ray diffraction · 2 distinct chains · 80% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProgrammed cell death protein 10protein18479% helix, 0% strandQ9BUL8
BSERINE/THREONINE-protein kinase MST4 (EC 2.7.11.1)protein6782% helix, 0% strandQ9P289

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11080.390.7519empty

Interfaces

1 interface between chains.

  • A–B · 1546 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 3W8I · Crystal structure of CCM3 in complex with the C-terminal regulatory domain of MST4 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9BUL8 · AlphaFold monomer V2.0 prediction for programmed cell death protein 10 (Q9BUL8) · a predicted model of the same protein · chain A against A, TM-score 0.95
  • Q9P289 · AlphaFold monomer V2.0 prediction for SERINE/THREONINE-protein kinase 26 (Q9P289) · a predicted model of the same protein · chain B against A, TM-score 0.88

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