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Yeast SMC2-SMC4 hinge domain with extended coiled coils

Analyse Yeast SMC2-SMC4 hinge domain with extended coiled coils in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4RSI
Type
protein
Length
669 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Structural maintenance of chromosomes protein 2; Structural maintenance of chromosomes…
UniProt
P38989, Q12267
Ligands
PO4
Pockets
8 · best druggability 0.73

Structure

x-ray diffraction · 2 distinct chains · 61% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AStructural maintenance of chromosomes protein 2protein28353% helix, 12% strandP38989
BStructural maintenance of chromosomes protein 4protein38666% helix, 8% strandQ12267

Ligands and binding sites

  • PO4 · Phosphate ion · ion · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14770.730.8258PO4
23550.650.8031empty
32940.610.7937PO4
41260.480.7918empty
5960.440.7918empty

Interfaces

1 interface between chains.

  • A–B · 2521 Ų buried · 35 hydrogen bonds · protein-protein

Compared structures

  • 4RSI · Yeast Smc2-Smc4 hinge domain with extended coiled coils · the same entry in another collection · chain A against A, TM-score 1.00
  • P38989 · AlphaFold monomer V2.0 prediction for structural maintenance of chromosomes protein 2… · a predicted model of the same protein · chain A against A, TM-score 0.93
  • Q12267 · AlphaFold monomer V2.0 prediction for structural maintenance of chromosomes protein 4… · a predicted model of the same protein · chain B against A, TM-score 0.76

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