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Apo form of glge isoform 1 from streptomyces coelicolor

Analyse Apo form of glge isoform 1 from streptomyces coelicolor in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3ZSS
Type
protein
Length
2,596 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative glucanohydrolase PEP1A
EC
2.4.1.-, 3.2.1.-
UniProt
Q9L1K2
Pockets
19 · best druggability 0.79

Structure

x-ray diffraction · 1 distinct chain · 34% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DPutative glucanohydrolase PEP1A (EC 2.4.1.-, 3.2.1.-)protein64934% helix, 25% strandQ9L1K2

Pockets

19 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110970.790.8184empty
211280.790.8192empty
311250.790.8093empty
411070.780.8077empty
510790.760.79121empty

Interfaces

3 interfaces between chains.

  • A–B · 2278 Ų buried · 33 hydrogen bonds · protein-protein
  • C–D · 2248 Ų buried · 30 hydrogen bonds · protein-protein
  • B–C · 61 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 3ZSS · Apo form of GlgE isoform 1 from Streptomyces coelicolor · the same entry in another collection · chain D against D, TM-score 1.00
  • Q9L1K2 · AlphaFold monomer V2.0 prediction for alpha-1,4-GLUCAN:MALTOSE-1-phosphate… · a predicted model of the same protein · chain C against A, TM-score 1.00

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