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MolNFT v1 · #161654 · protein

Crystal structure of nucleotide-free MGM1

6QL4 · Putative mitochondrial dynamin protein: “Crystal structure of nucleotide-free MGM1”. X-ray diffraction, 15 pockets (best druggability 0.77). MolNFT v1 #161654 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6QL4
Type
protein
Length
1,320 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Putative mitochondrial dynamin protein
UniProt
G0SGC7
Pockets
15 · best druggability 0.77

Structure

x-ray diffraction · 2 distinct chains · 64% helix, 7% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APutative mitochondrial dynamin proteinprotein66063% helix, 7% strandG0SGC7
BPutative mitochondrial dynamin proteinprotein66064% helix, 7% strandG0SGC7

Ligands and binding sites

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

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

Pockets

15 pockets found on a 1 Å grid, 5 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11110.770.9633empty
21680.720.9036empty
3540.700.9721empty
4910.680.9233empty
52310.540.7726empty

Interfaces

1 interface between chains.

  • A–B · 635 Ų buried · 2 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 24 modified, 2 disulfide (engineered, disulfide).

Compared structures

  • 6QL4 · Crystal structure of nucleotide-free Mgm1 · the same entry in another collection · chain A against A, TM-score 1.00

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