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MolNFT v1 · #53672 · protein

Gelsolin nanobody

2X1P: “Gelsolin nanobody”. X-ray diffraction, 8 pockets (best druggability 0.55). MolNFT v1 #53672 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2X1P
Type
protein
Length
472 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Gelsolin nanobody
Pockets
8 · best druggability 0.55

Structure

x-ray diffraction · 1 distinct chain · 5% helix, 47% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DGelsolin nanobodyprotein1185% helix, 47% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12910.550.7650empty
2650.460.8317empty
3650.450.8317empty
4720.440.8117empty
5710.420.8017empty

Interfaces

5 interfaces between chains.

  • C–D · 457 Ų buried · 7 hydrogen bonds · protein-protein
  • A–B · 454 Ų buried · 7 hydrogen bonds · protein-protein
  • A–C · 440 Ų buried · 9 hydrogen bonds · protein-protein
  • B–D · 196 Ų buried · 4 hydrogen bonds · protein-protein
  • B–C · 112 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 2X1P · Gelsolin Nanobody · the same entry in another collection · chain A against A, TM-score 1.00

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