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Ngf in complex with MEDI578 scfv

Analyse Ngf in complex with MEDI578 scfv in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5JZ7
Type
protein
Length
1,392 residues
Chains
12
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Beta-nerve growth factor; MEDI578 scfv, heavy chain; MEDI578 scfv, light chain
UniProt
P01138
Pockets
19 · best druggability 0.78

Structure

x-ray diffraction · 3 distinct chains · 3% helix, 54% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, E, FBeta-nerve growth factorprotein1100% helix, 65% strandP01138
C, G, H, JMEDI578 scfv, heavy chainprotein1285% helix, 51% strand—
D, I, K, LMEDI578 scfv, light chainprotein1105% helix, 48% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16690.780.8375empty
26530.780.8473empty
31070.770.9629empty
41050.760.9630empty
51850.520.7823empty

Interfaces

29 interfaces between chains.

  • A–B · 1876 Ų buried · 16 hydrogen bonds · protein-protein
  • E–F · 1868 Ų buried · 15 hydrogen bonds · protein-protein
  • H–L · 857 Ų buried · 10 hydrogen bonds · protein-protein
  • G–I · 857 Ų buried · 9 hydrogen bonds · protein-protein
  • J–K · 855 Ų buried · 9 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 20 disulfide (disulfide).

Compared structures

  • 5JZ7 · NGF IN COMPLEX WITH MEDI578 scFv · the same entry in another collection · chain H against H, TM-score 1.00

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