GL1X · GenesisL1 explorer

MolNFT v1 · #60317 · protein

MLOTIK1 ion channel cyclic-nucleotide binding domain mutant

3CO2 · MLOTIK1 ion channel protein: “MLOTIK1 ion channel cyclic-nucleotide binding domain mutant”. X-ray diffraction, 7 pockets (best druggability 0.66). MolNFT v1 #60317 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3CO2
Type
protein
Length
502 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
MLOTIK1 ion channel protein
UniProt
Q98GN8
Pockets
7 · best druggability 0.66

Structure

x-ray diffraction · 4 distinct chains · 33% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMLOTIK1 ion channel proteinprotein12634% helix, 25% strandQ98GN8
BMLOTIK1 ion channel proteinprotein12834% helix, 28% strandQ98GN8
CMLOTIK1 ion channel proteinprotein11929% helix, 29% strandQ98GN8
DMLOTIK1 ion channel proteinprotein12934% helix, 29% strandQ98GN8

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16390.660.7552empty
21790.560.8022empty
31280.530.8120empty
4840.440.8017empty
5850.410.7818empty

Interfaces

5 interfaces between chains.

  • B–C · 854 Ų buried · 8 hydrogen bonds · protein-protein
  • A–D · 745 Ų buried · 7 hydrogen bonds · protein-protein
  • A–B · 376 Ų buried · 0 hydrogen bonds · protein-protein
  • C–D · 356 Ų buried · 0 hydrogen bonds · protein-protein
  • A–C · 97 Ų buried · 2 hydrogen bonds · protein-protein

Compared structures

  • 3CO2 · Mlotik1 ion channel cyclic-nucleotide binding domain mutant · the same entry in another collection · chain D against D, TM-score 1.00
  • Q98GN8 · AlphaFold monomer V2.0 prediction for cyclic nucleotide-gated potassium channel MLL3241… · a predicted model of the same protein · chain C against A, TM-score 0.78

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