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MolNFT v1 · #149315 · protein

Chimeric titin Z1Z2-Z1Z2 tandem (Z1212) functionalized with a grgds exogenous peptide from fibronectin

6FWX · TITIN,TITIN,TITIN: “Chimeric titin Z1Z2-Z1Z2 tandem (Z1212) functionalized with a grgds exogenous peptide from fibronectin”. X-ray diffraction, 1 pocket (best druggability 0.72). MolNFT v1 #149315 on GenesisL1: 3D structure, binding…

PDB
6FWX
Type
protein
Length
390 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
TITIN,TITIN,TITIN
EC
2.7.11.1
UniProt
Q8WZ42
Pockets
1 · best druggability 0.72

Structure

x-ray diffraction · 2 distinct chains · 2% helix, 60% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATITIN,TITIN,TITIN (EC 2.7.11.1)protein1953% helix, 59% strandQ8WZ42
BTITIN,TITIN,TITIN (EC 2.7.11.1)protein1952% helix, 61% strandQ8WZ42

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1690.720.9717empty

Interfaces

1 interface between chains.

  • A–B · 582 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 6FWX · Chimeric titin Z1Z2-Z1Z2 tandem (Z1212) functionalized with a GRGDS exogenous peptide… · the same entry in another collection · chain A against A, TM-score 1.00

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