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MolNFT v1 · #71649 · protein

Low pH as-isolated tomato chloroplast superoxide dismutase

3MKG · Superoxide dismutase [cu-zn], chloroplastic: “Low pH as-isolated tomato chloroplast superoxide dismutase”. X-ray diffraction, 1 ligand (ZN), 2 pockets (best druggability 0.57). MolNFT v1 #71649 on GenesisL1: 3D structure, binding…

PDB
3MKG
Type
protein
Length
246 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Superoxide dismutase [cu-zn], chloroplastic
EC
1.15.1.1
UniProt
P14831
Ligands
ZN
Pockets
2 · best druggability 0.57

Structure

x-ray diffraction · 2 distinct chains · 4% helix, 49% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASuperoxide dismutase [cu-zn], chloroplastic (EC 1.15.1.1)protein1244% helix, 48% strandP14831
BSuperoxide dismutase [cu-zn], chloroplastic (EC 1.15.1.1)protein1224% helix, 49% strandP14831

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11990.570.8029empty
2940.360.7619empty

Interfaces

1 interface between chains.

  • A–B · 682 Ų buried · 6 hydrogen bonds · protein-protein

Compared structures

  • 3MKG · Low pH as-isolated tomato chloroplast superoxide dismutase · the same entry in another collection · chain A against A, TM-score 1.00
  • P14831 · AlphaFold monomer V2.0 prediction for superoxide dismutase [cu-zn], chloroplastic (P14831) · a predicted model of the same protein · chain B against A, TM-score 0.99

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