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MolNFT v1 · #120174 · protein

Crystal structure of homo-specific diabody

5GRV · Homo-specific diabody heavy chain: “Crystal structure of homo-specific diabody”. X-ray diffraction, 2 pockets (best druggability 0.46). MolNFT v1 #120174 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5GRV
Type
protein
Length
229 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Homo-specific diabody heavy chain; Homo-specific diabody light chain
Pockets
2 · best druggability 0.46

Structure

x-ray diffraction · 2 distinct chains · 9% helix, 48% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
LHomo-specific diabody heavy chainprotein12312% helix, 50% strand—
KHomo-specific diabody light chainprotein1066% helix, 46% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1800.460.8120empty
2800.320.7417empty

Interfaces

1 interface between chains.

  • L–K · 722 Ų buried · 7 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 5GRV · Crystal structure of homo-specific diabody · the same entry in another collection · chain L against L, TM-score 1.00

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