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MolNFT v1 · #189690 · protein

De novo designed protein based on 1R26

7VQW: “De novo designed protein based on 1R26”. X-ray diffraction, 5 pockets (best druggability 0.49). MolNFT v1 #189690 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7VQW
Type
protein
Length
232 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
De novo designed protein
Pockets
5 · best druggability 0.49

Structure

x-ray diffraction · 1 distinct chain · 38% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BDe novo designed proteinprotein11638% helix, 25% strand—

Pockets

5 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1530.490.8615empty
21760.490.7716empty
3580.490.8513empty
41050.370.7418empty
51050.370.7421empty

Interfaces

1 interface between chains.

  • A–B · 256 Ų buried · 6 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 7VQW · de novo designed protein based on 1r26 · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

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