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MolNFT v1 · #154287 · protein

Application of anti-helix antibodies in protein structure determination (8420-3MNZ)

6K68 · 3MNZ variable heavy chain: “Application of anti-helix antibodies in protein structure determination (8420-3MNZ)”. X-ray diffraction, 14 pockets (best druggability 0.67). MolNFT v1 #154287 on GenesisL1: 3D structure, binding sites…

PDB
6K68
Type
protein
Length
1,089 residues
Chains
12
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
3MNZ variable heavy chain; 3MNZ variable light chain; Protein a
Pockets
14 · best druggability 0.67

Structure

x-ray diffraction · 4 distinct chains · 15% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, C, F3MNZ variable heavy chainprotein11011% helix, 53% strand—
B, D, G, K3MNZ variable light chainprotein1123% helix, 46% strand—
E, H, I, LProtein aprotein5066% helix, 2% strand—
J3MNZ variable heavy chainprotein1118% helix, 52% strand—

Pockets

14 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17050.670.7582empty
23760.600.7726empty
32850.530.7552empty
41850.470.7626empty
51820.470.7631empty

Interfaces

17 interfaces between chains.

  • J–K · 707 Ų buried · 5 hydrogen bonds · protein-protein
  • F–G · 691 Ų buried · 5 hydrogen bonds · protein-protein
  • A–B · 684 Ų buried · 4 hydrogen bonds · protein-protein
  • C–D · 672 Ų buried · 5 hydrogen bonds · protein-protein
  • J–L · 500 Ų buried · 12 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 6K68 · Application of anti-helix antibodies in protein structure determination (8420-3MNZ) · the same entry in another collection · chain A against A, TM-score 1.00

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