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MolNFT v1 · #173155 · protein

Model of the actin filament ARP2/3 complex branch junction in cells

7AQK · Actin-related protein 2, ARP2: “Model of the actin filament ARP2/3 complex branch junction in cells”. Electron microscopy, 20 pockets (best druggability 0.73). MolNFT v1 #173155 on GenesisL1: 3D structure, binding sites and pockets…

PDB
7AQK
Type
protein
Length
6,001 residues
Chains
18
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Actin-related protein 2, ARP2; Actin-related protein 3, ARP3; Actin-related protein 2/3…
Pockets
20 · best druggability 0.73

Structure

electron microscopy · 8 distinct chains · 35% helix, 18% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
bActin-related protein 2, ARP2protein38736% helix, 18% strand—
aActin-related protein 3, ARP3protein41837% helix, 16% strand—
cActin-related protein 2/3 complex subunit 1B, ARPC1Bprotein3725% helix, 41% strand—
dActin-related protein 2/3 complex subunit 2, ARPC2protein28141% helix, 17% strand—
eActin-related protein 2/3 complex subunit 3, ARPC3protein17844% helix, 3% strand—
fActin-related protein 2/3 complex subunit 4, ARPC4protein16842% helix, 14% strand—
gActin-related protein 2/3 complex subunit 5, ARPC5protein11672% helix, 0% strand—
h, i, j, k, l, m, n, o, p, q, rActin, alpha skeletal muscle, ACTA1protein37138% helix, 13% strand—

Pockets

20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110970.730.77141empty
28280.720.78100empty
38760.710.77105empty
49060.710.77124empty
510710.670.74116empty

Interfaces

35 interfaces between chains.

  • c–f · 283 Ų buried · 7 hydrogen bonds · protein-protein
  • f–g · 259 Ų buried · 5 hydrogen bonds · protein-protein
  • a–d · 242 Ų buried · 6 hydrogen bonds · protein-protein
  • a–h · 217 Ų buried · 5 hydrogen bonds · protein-protein
  • h–i · 196 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 7AQK · Model of the actin filament Arp2/3 complex branch junction in cells · the same entry in another collection · chain b against b, TM-score 1.00

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