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Cryoem structure of mical oxidized actin (class 1)

Analyse Cryoem structure of mical oxidized actin (class 1) in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6AV9
Type
protein
Length
1,101 residues
Chains
3
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Actin, alpha skeletal muscle
UniProt
P68135
Ligands
ADP
Pockets
6 · best druggability 0.82

Structure

electron microscopy · 1 distinct chain · 32% helix, 12% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
C, A, BActin, alpha skeletal muscleprotein36732% helix, 12% strandP68135

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · 3 copies · chains C, A, B

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

Pockets

6 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19760.820.84118empty
21890.730.8944ADP
31860.710.8942ADP
41980.710.8847ADP
51410.430.7527empty

Interfaces

3 interfaces between chains.

  • A–B · 1125 Ų buried · 17 hydrogen bonds · protein-protein
  • C–A · 461 Ų buried · 6 hydrogen bonds · protein-protein
  • C–B · 451 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 9 modified (nonstandard, methylation).

Compared structures

  • 6AV9 · CryoEM structure of Mical Oxidized Actin (Class 1) · the same entry in another collection · chain C against C, TM-score 1.00
  • P68135 · AlphaFold monomer V2.0 prediction for actin, alpha skeletal muscle (P68135) · a predicted model of the same protein · chain A against A, TM-score 0.96

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