GL1X · GenesisL1 explorer

MolNFT v1 · #114995 · protein

Structural insights into the SCC2-SCC4 cohesin loader

5C6G · AGR133CP: “Structural insights into the SCC2-SCC4 cohesin loader”. X-ray diffraction, 19 pockets (best druggability 0.78). MolNFT v1 #114995 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5C6G
Type
protein
Length
1,440 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
AGR133CP; Sister chromatid cohesion protein 2
UniProt
Q74ZR5, Q750S2
Pockets
19 · best druggability 0.78

Structure

x-ray diffraction · 4 distinct chains · 65% helix, 3% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAGR133CPprotein60574% helix, 2% strandQ74ZR5
BSister chromatid cohesion protein 2protein12621% helix, 9% strandQ750S2
CAGR133CPprotein58874% helix, 2% strandQ74ZR5
DSister chromatid cohesion protein 2protein12122% helix, 7% strandQ750S2

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18590.780.8179empty
210760.740.7775empty
34000.640.7835empty
41350.640.8721empty
51630.630.8522empty

Interfaces

4 interfaces between chains.

  • A–B · 6215 Ų buried · 69 hydrogen bonds · protein-protein
  • C–D · 6065 Ų buried · 69 hydrogen bonds · protein-protein
  • A–C · 142 Ų buried · 2 hydrogen bonds · protein-protein
  • A–D · 122 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 5C6G · Structural Insights into the Scc2-Scc4 Cohesin Loader · the same entry in another collection · chain A against A, TM-score 1.00
  • Q750S2 · AlphaFold monomer V2.0 prediction for sister chromatid cohesion protein 2 (Q750S2) · a predicted model of the same protein · chain D against A, TM-score 0.41

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