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MolNFT v1 · #176600 · protein

Crystal structure of actin capping protein in complex with twinflin-1 C-terminus tail

7DS2 · F-actin-capping protein subunit alpha-1: “Crystal structure of actin capping protein in complex with twinflin-1 C-terminus tail”. X-ray diffraction, 6 pockets (best druggability 0.73). MolNFT v1 #176600 on GenesisL1: 3D structure…

PDB
7DS2
Type
protein
Length
530 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, Q91YR1
Pockets
6 · best druggability 0.73

Structure

x-ray diffraction · 3 distinct chains · 39% helix, 34% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AF-actin-capping protein subunit alpha-1protein27240% helix, 34% strandP13127
BF-actin-capping protein subunit beta isoforms 1protein23540% helix, 37% strandP14315
CTwinfilin-1protein230% helix, 4% strandQ91YR1

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1760.730.9723empty
22530.640.8228empty
31380.410.7519empty
4500.360.8017empty
5660.350.7718empty

Interfaces

3 interfaces between chains.

  • A–B · 3680 Ų buried · 57 hydrogen bonds · protein-protein
  • B–C · 1568 Ų buried · 29 hydrogen bonds · protein-protein
  • A–C · 37 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7DS2 · Crystal structure of actin capping protein in complex with twinflin-1 C-terminus tail · 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 0.97
  • 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
  • Q91YR1 · AlphaFold monomer V2.0 prediction for twinfilin-1 (Q91YR1) · a predicted model of the same protein · chain C against A, TM-score 0.48

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