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MolNFT v1 · #21609 · protein

Crystal structure of the receptor-ligand complex between nerve growth factor and the common neurotrophin receptor P75

1SG1 · Beta-nerve growth factor: “Crystal structure of the receptor-ligand complex between nerve growth factor and the common neurotrophin…”. X-ray diffraction, 1 ligand (CL), 5 pockets (best druggability 0.79). MolNFT v1 #21609 on…

PDB
1SG1
Type
protein
Length
361 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beta-nerve growth factor; Tumor necrosis factor receptor superfamily member 16
UniProt
P01138, P07174
Ligands
CL
Pockets
5 · best druggability 0.79

Structure

x-ray diffraction · 3 distinct chains · 0% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ABeta-nerve growth factorprotein990% helix, 63% strandP01138
BBeta-nerve growth factorprotein1020% helix, 59% strandP01138
XTumor necrosis factor receptor superfamily member 16protein1600% helix, 34% strandP07174

Ligands and binding sites

  • CL · Chloride ion · ion · 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
12400.790.9134empty
27250.720.7859CL
31550.440.7530empty
4900.340.7420empty
5510.310.7717empty

Interfaces

3 interfaces between chains.

  • A–B · 1467 Ų buried · 15 hydrogen bonds · protein-protein
  • A–X · 655 Ų buried · 5 hydrogen bonds · protein-protein
  • B–X · 644 Ų buried · 5 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 18 disulfide (disulfide).

Compared structures

  • 1SG1 · Crystal Structure of the Receptor-Ligand Complex between Nerve Growth Factor and the… · the same entry in another collection · chain A against A, TM-score 1.00
  • P07174 · AlphaFold monomer V2.0 prediction for tumor necrosis factor receptor superfamily member… · a predicted model of the same protein · chain X against A, TM-score 0.91
  • P01138 · AlphaFold monomer V2.0 prediction for beta-nerve growth factor (P01138) · a predicted model of the same protein · chain A against A, TM-score 0.89

Analyse

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