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Structural basis for SCC3-dependent cohesin recruitment to chromatin

Analyse Structural basis for SCC3-dependent cohesin recruitment to chromatin in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6H8Q
Type
protein + DNA
Length
1,885 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cohesin subunit SCC3; Sister chromatid cohesion protein 1; DNA (5'…
UniProt
P40541, Q12158
Pockets
20 · best druggability 0.84

Structure

x-ray diffraction · 8 distinct chains · 63% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACohesin subunit SCC3protein87964% helix, 0% strandP40541
BCohesin subunit SCC3protein87363% helix, 0% strandP40541
GSister chromatid cohesion protein 1protein3050% helix, 0% strandQ12158
HSister chromatid cohesion protein 1protein2756% helix, 0% strandQ12158
EDNA (5'- D(P*CP*TP*TP*TP*CP*GP*TP*TP*TP*CP*CP*TP*TP*GP*AP*AP*AP*AP*A)-3')dna19——
FDNA (5'- D(P*CP*TP*TP*TP*CP*GP*TP*TP*TP*CP*CP*TP*TP*GP*AP*AP*AP*AP*A)-3')dna19——
CDNA (5'- D(P*TP*TP*TP*TP*TP*CP*AP*AP*GP*GP*AP*AP*AP*CP*GP*AP*AP*AP*G)-3')dna19——
DDNA (5'- D(P*CP*TP*TP*TP*CP*GP*TP*TP*TP*CP*CP*TP*TP*GP*AP*AP*AP*AP*A)-3')dna19——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13660.840.9352empty
22920.820.9245empty
38630.800.8293empty
47780.760.8172empty
55200.750.8341empty

Interfaces

11 interfaces between chains.

  • A–G · 1104 Ų buried · 4 hydrogen bonds · protein-protein
  • B–H · 1033 Ų buried · 8 hydrogen bonds · protein-protein
  • C–D · 850 Ų buried · 64 hydrogen bonds · nucleic-nucleic
  • E–F · 832 Ų buried · 59 hydrogen bonds · nucleic-nucleic
  • A–B · 569 Ų buried · 4 hydrogen bonds · protein-protein

Compared structures

  • 6H8Q · Structural basis for Scc3-dependent cohesin recruitment to chromatin · the same entry in another collection · chain D against D, TM-score 1.00
  • P40541 · AlphaFold monomer V2.0 prediction for cohesin subunit SCC3 (P40541) · a predicted model of the same protein · chain B against A, TM-score 0.96
  • Q12158 · AlphaFold monomer V2.0 prediction for sister chromatid cohesion protein 1 (Q12158) · a predicted model of the same protein · chain H against A, TM-score 0.55

Analyse

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