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MolNFT v1 · #171686 · protein

Crystal structure of YTHDC1 S378A mutant

6ZD4 · Yth domain containing 1: “Crystal structure of YTHDC1 S378A mutant”. X-ray diffraction, 1 ligand (SO4), 5 pockets (best druggability 0.72). MolNFT v1 #171686 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6ZD4
Type
protein
Length
319 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Yth domain containing 1
Ligands
SO4
Pockets
5 · best druggability 0.72

Structure

x-ray diffraction · 2 distinct chains · 33% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AYth domain containing 1protein15533% helix, 26% strand—
BYth domain containing 1protein16433% helix, 25% strand—

Ligands and binding sites

  • SO4 · Sulfate ion · ion · 7 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11870.720.8931SO4
21240.540.8216empty
3940.390.7617empty
4600.280.7313empty
5560.270.7416empty

Interfaces

1 interface between chains.

  • A–B · 605 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 6ZD4 · Crystal structure of YTHDC1 S378A mutant · the same entry in another collection · chain A against A, TM-score 1.00

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