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Crystal structure of anti-MTFP1 darpin 1238_E11

Analyse Crystal structure of anti-MTFP1 darpin 1238_E11 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6FP9
Type
protein
Length
334 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Darpin 1238_E11
Ligands
SO4
Pockets
3 · best druggability 0.70

Structure

x-ray diffraction · 2 distinct chains · 55% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BDarpin 1238_E11protein16357% helix, 0% strand—
ADarpin 1238_E11protein17154% helix, 0% strand—

Ligands and binding sites

  • SO4 · Sulfate ion · ion · chains B, A
  • EDO · 1,2-ethanediol · additive · 3 copies · chains B, A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13370.700.8342EDO
21810.450.7524SO4
3680.300.7313EDO

Interfaces

1 interface between chains.

  • B–A · 606 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 6FP9 · Crystal structure of anti-mTFP1 DARPin 1238_E11 · the same entry in another collection · chain B against B, TM-score 1.00

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