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MolNFT v1 · #176605 · protein

Crystal structure of actin capping protein in complex with twinflin- 1/CD2AP cpi chimera peptide (cdn-twc)

7DS8 · F-actin-capping protein subunit alpha-1: “Crystal structure of actin capping protein in complex with twinflin- 1/CD2AP cpi chimera peptide (cdn-twc)”. X-ray diffraction, 5 pockets (best druggability 0.78). MolNFT v1 #176605 on…

PDB
7DS8
Type
protein
Length
528 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
F-actin-capping protein subunit alpha-1; F-actin-capping protein subunit beta isoforms 1…
UniProt
P13127, P14315, Q9Y5K6
Pockets
5 · best druggability 0.78

Structure

x-ray diffraction · 3 distinct chains · 40% helix, 34% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AF-actin-capping protein subunit alpha-1protein27441% helix, 33% strandP13127
BF-actin-capping protein subunit beta isoforms 1protein24240% helix, 36% strandP14315
CCD2-associated PROTEIN,TWINFILIN-1protein1233% helix, 0% strandQ9Y5K6

Pockets

5 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11110.780.9719empty
2980.520.8320empty
31360.440.7627empty
4830.420.7919empty
5860.350.7513empty

Interfaces

3 interfaces between chains.

  • A–B · 3712 Ų buried · 62 hydrogen bonds · protein-protein
  • B–C · 803 Ų buried · 10 hydrogen bonds · protein-protein
  • A–C · 109 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7DS8 · Crystal structure of actin capping protein in complex with twinflin-1/CD2AP CPI chimera… · the same entry in another collection · chain A against A, TM-score 1.00
  • P14315 · AlphaFold monomer V2.0 prediction for F-actin-capping protein subunit beta isoforms 1 and… · a predicted model of the same protein · chain B against A, TM-score 0.99
  • P13127 · AlphaFold monomer V2.0 prediction for F-actin-capping protein subunit alpha-1 (P13127) · a predicted model of the same protein · chain A against A, TM-score 0.94
  • Q9Y5K6 · AlphaFold monomer V2.0 prediction for CD2-associated protein (Q9Y5K6) · a predicted model of the same protein · chain C against A, TM-score 0.35

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