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REF6 ZNF2-4-NAC004-MC1 complex

Analyse REF6 ZNF2-4-NAC004-MC1 complex in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6JNN
Type
protein + DNA
Length
451 residues
Chains
12
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Lysine-specific demethylase REF6; DNA (5'-D(*TP*TP*(5CM)P*TP*CP*TP*GP*TP*TP*TP*TP*G)-3')…
EC
1.14.11.-
UniProt
Q9STM3
Ligands
ZN
Pockets
8 · best druggability 0.75

Structure

x-ray diffraction · 4 distinct chains · 38% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, NLysine-specific demethylase REF6 (EC 1.14.11.-)protein8937% helix, 13% strandQ9STM3
D, F, I, LDNA (5'-D(*TP*TP*(5CM)P*TP*CP*TP*GP*TP*TP*TP*TP*G)-3')dna12——
C, E, H, KDNA (5'-D(*CP*AP*AP*AP*AP*CP*AP*GP*AP*GP*AP*A)-3')dna12——
GLysine-specific demethylase REF6 (EC 1.14.11.-)protein8839% helix, 8% strandQ9STM3

Ligands and binding sites

  • ZN · Zinc ion · metal · 12 copies · chains A, B, N, G

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

Pockets

8 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17370.750.8059empty
28940.750.7978empty
34500.620.7646empty
42210.570.7924empty
51900.560.8022empty

Interfaces

27 interfaces between chains.

  • L–G · 770 Ų buried · 8 hydrogen bonds · protein-nucleic
  • B–F · 755 Ų buried · 10 hydrogen bonds · protein-nucleic
  • A–D · 753 Ų buried · 7 hydrogen bonds · protein-nucleic
  • I–N · 732 Ų buried · 4 hydrogen bonds · protein-nucleic
  • F–E · 538 Ų buried · 53 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 4 modified (nucleotide modification).

Compared structures

  • 6JNN · REF6 ZnF2-4-NAC004-mC1 complex · the same entry in another collection · chain G against G, TM-score 1.00

Analyse

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