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MolNFT v1 · #53440 · protein

Bacterial actin mreb assembles in complex with cell shape protein rodz

2WUS · Rod shape-determining protein mreb: “Bacterial actin mreb assembles in complex with cell shape protein rodz”. X-ray diffraction, 9 pockets (best druggability 0.71). MolNFT v1 #53440 on GenesisL1: 3D structure, binding sites and…

PDB
2WUS
Type
protein
Length
837 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Rod shape-determining protein mreb; Putative uncharacterized protein
UniProt
Q9WZ57, Q9X2H8
Pockets
9 · best druggability 0.71

Structure

x-ray diffraction · 4 distinct chains · 44% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARod shape-determining protein mrebprotein33541% helix, 26% strandQ9WZ57
BRod shape-determining protein mrebprotein33337% helix, 25% strandQ9WZ57
RPutative uncharacterized proteinprotein8770% helix, 0% strandQ9X2H8
SPutative uncharacterized proteinprotein8263% helix, 0% strandQ9X2H8

Pockets

9 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13250.710.8452empty
23660.630.7838empty
33460.630.7944empty
4580.470.8420empty
51400.440.7631empty

Interfaces

3 interfaces between chains.

  • A–R · 620 Ų buried · 9 hydrogen bonds · protein-protein
  • B–S · 555 Ų buried · 9 hydrogen bonds · protein-protein
  • A–B · 253 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 2WUS · Bacterial actin MreB assembles in complex with cell shape protein RodZ · the same entry in another collection · chain A against A, TM-score 1.00

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