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MolNFT v1 · #79714 · protein

Crystal structure of domain VI and LE1 of human netrin-G2

3TBD: “Crystal structure of domain VI and LE1 of human netrin-G2”. X-ray diffraction, 4 ligands (NAG, CA, PO4), 4 pockets (best druggability 0.57). MolNFT v1 #79714 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3TBD
Type
protein
Length
331 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Netrin-G2
UniProt
Q96CW9
Ligands
NAG, CA, PO4, CL
Pockets
4 · best druggability 0.57

Structure

x-ray diffraction · 1 distinct chain · 13% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANetrin-G2protein33113% helix, 32% strandQ96CW9

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 4 copies · chains A
  • CA · Calcium ion · metal · chains A
  • PO4 · Phosphate ion · ion · 2 copies · chains A
  • CL · Chloride ion · ion · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11160.570.8419empty
21020.470.8019empty
3790.380.7716empty
4500.380.8116PO4

Modifications

Observed in the structure: 8 disulfide, 2 glycan (disulfide, N-glycosylation).

Compared structures

  • 3TBD · Crystal Structure of domain VI and LE1 of human Netrin-G2 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q96CW9 · AlphaFold monomer V2.0 prediction for netrin-G2 (Q96CW9) · a predicted model of the same protein · chain A against A, TM-score 0.97

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