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Crystal structure of SUVH5 sra- methylated chh DNA complex

Analyse Crystal structure of SUVH5 sra- methylated chh DNA complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3Q0F
Type
protein + DNA
Length
312 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Histone-lysine N-methyltransferase, H3 lysine-9 specific SUVH5; DNA…
EC
2.1.1.43
UniProt
O82175
Pockets
5 · best druggability 0.66

Structure

x-ray diffraction · 4 distinct chains · 12% helix, 36% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
XHistone-lysine N-methyltransferase, H3 lysine-9 specific SUVH5 (EC 2.1.1.43)protein14512% helix, 36% strandO82175
AHistone-lysine N-methyltransferase, H3 lysine-9 specific SUVH5 (EC 2.1.1.43)protein14612% helix, 36% strandO82175
BDNA (5'-D(*CP*TP*GP*AP*GP*GP*AP*GP*TP*AP*T)-3')dna11——
CDNA (5'-D(*TP*AP*CP*TP*(5CM)P*CP*TP*CP*AP*G)-3')dna10——

Pockets

5 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12360.660.8430empty
22080.650.8422empty
3890.290.7214empty
4680.280.7312empty
5600.260.7312empty

Interfaces

6 interfaces between chains.

  • A–B · 601 Ų buried · 17 hydrogen bonds · protein-nucleic
  • X–C · 567 Ų buried · 15 hydrogen bonds · protein-nucleic
  • B–C · 420 Ų buried · 38 hydrogen bonds · nucleic-nucleic
  • X–A · 274 Ų buried · 0 hydrogen bonds · protein-protein
  • X–B · 244 Ų buried · 3 hydrogen bonds · protein-nucleic

Modifications

Observed in the structure: 1 modified (nucleotide modification).

Compared structures

  • 3Q0F · Crystal structure of SUVH5 SRA- methylated CHH DNA complex · the same entry in another collection · chain X against X, TM-score 1.00
  • O82175 · AlphaFold monomer V2.0 prediction for histone-lysine N-methyltransferase, H3 lysine-9… · a predicted model of the same protein · chain X against A, TM-score 0.96

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