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MolNFT v1 · #170112 · protein

The unique CBM3-CLOCL_1192 of hungateiclostridium clariflavum

6XX1 · Cellulose binding domain-containing protein: “The unique CBM3-CLOCL_1192 of hungateiclostridium clariflavum”. X-ray diffraction, 2 pockets (best druggability 0.51). MolNFT v1 #170112 on GenesisL1: 3D structure, binding sites and…

PDB
6XX1
Type
protein
Length
590 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cellulose binding domain-containing protein
UniProt
G8LYV1
Pockets
2 · best druggability 0.51

Structure

x-ray diffraction · 3 distinct chains · 8% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BCellulose binding domain-containing proteinprotein1488% helix, 45% strandG8LYV1
CCellulose binding domain-containing proteinprotein1488% helix, 45% strandG8LYV1
DCellulose binding domain-containing proteinprotein1468% helix, 46% strandG8LYV1

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11590.510.7922empty
2740.280.7318empty

Interfaces

3 interfaces between chains.

  • A–B · 721 Ų buried · 11 hydrogen bonds · protein-protein
  • C–D · 693 Ų buried · 10 hydrogen bonds · protein-protein
  • B–C · 392 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 6XX1 · The unique CBM3-Clocl_1192 of Hungateiclostridium clariflavum · the same entry in another collection · chain A against A, TM-score 1.00

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