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MolNFT v1 · #13279 · protein

Crystal structure of human matrix metalloproteinase MMP9 (gelatinase B).

1L6J · Matrix metalloproteinase-9: “Crystal structure of human matrix metalloproteinase MMP9 (gelatinase B).”. X-ray diffraction, 2 ligands (CA, ZN), 5 pockets (best druggability 0.63). MolNFT v1 #13279 on GenesisL1: 3D structure, binding…

PDB
1L6J
Type
protein
Length
405 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Matrix metalloproteinase-9
EC
3.4.24.35
UniProt
P14780
Ligands
CA, ZN
Pockets
5 · best druggability 0.63

Structure

x-ray diffraction · 1 distinct chain · 20% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMatrix metalloproteinase-9 (EC 3.4.24.35)protein40520% helix, 19% strandP14780

Ligands and binding sites

  • CA · Calcium ion · metal · 3 copies · chains A
  • ZN · Zinc ion · metal · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1970.630.8920empty
24380.590.7551CA
31450.460.7717empty
4750.450.8116empty
5730.330.7521empty

Modifications

Observed in the structure: 6 disulfide (disulfide).

Compared structures

  • 1L6J · Crystal structure of human matrix metalloproteinase MMP9 (gelatinase B). · the same entry in another collection · chain A against A, TM-score 1.00
  • P14780 · AlphaFold monomer V2.0 prediction for matrix metalloproteinase-9 (P14780) · a predicted model of the same protein · chain A against A, TM-score 0.87

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