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MolNFT v1 · #47087 · protein

Structure of lnr-hd (negative regulatory region) from human notch 2

2OO4 · Neurogenic locus notch homolog protein 2: “Structure of lnr-hd (negative regulatory region) from human notch 2”. X-ray diffraction, 2 ligands (CA, ZN), 5 pockets (best druggability 0.75). MolNFT v1 #47087 on GenesisL1: 3D structure…

PDB
2OO4
Type
protein
Length
452 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Neurogenic locus notch homolog protein 2
UniProt
Q04721
Ligands
CA, ZN
Pockets
5 · best druggability 0.75

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BNeurogenic locus notch homolog protein 2protein22634% helix, 16% strandQ04721

Ligands and binding sites

  • CA · Calcium ion · metal · 6 copies · chains A, B
  • ZN · Zinc ion · metal · chains A
  • GOL · Glycerol · additive · 10 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
18630.750.7968GOL
22230.570.7945empty
31860.450.7526empty
4850.370.7623GOL
5730.300.7320empty

Interfaces

1 interface between chains.

  • A–B · 440 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 19 disulfide (disulfide).

Compared structures

  • 2OO4 · Structure of LNR-HD (Negative Regulatory Region) from human Notch 2 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q04721 · AlphaFold monomer V2.0 prediction for neurogenic locus notch homolog protein 2 (Q04721) · a predicted model of the same protein · chain A against A, TM-score 0.96

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