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Crystal structure of photosynthetic glyceraldehyde-3-phosphate dehydrogenase from chlamydomonas reinhardtii (crgapa) complexed with NADP+ and the oxidated catalytic cysteine

Analyse Crystal structure of photosynthetic glyceraldehyde-3-phosphate dehydrogenase… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7ZQ4
Type
protein
Length
684 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glyceraldehyde-3-phosphate dehydrogenase a, chloroplastic
EC
1.2.1.13
UniProt
P50362
Ligands
NDP, SO4
Pockets
1 · best druggability 0.76

Structure

x-ray diffraction · 2 distinct chains · 30% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
OGlyceraldehyde-3-phosphate dehydrogenase a, chloroplastic (EC 1.2.1.13)protein33830% helix, 27% strandP50362
RGlyceraldehyde-3-phosphate dehydrogenase a, chloroplastic (EC 1.2.1.13)protein34630% helix, 26% strandP50362

Ligands and binding sites

  • NDP · Nadph dihydro-nicotinamide-adenine-dinucleotide phosphate · ligand · 2 copies · chains O, R
  • SO4 · Sulfate ion · ion · 7 copies · chains O, R
  • EDO · 1,2-ethanediol · additive · chains O
  • GOL · Glycerol · additive · chains R

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110070.760.79122NDP, SO4

Interfaces

1 interface between chains.

  • O–R · 1396 Ų buried · 21 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 modified (oxidation).

Compared structures

  • 7ZQ4 · Crystal structure of photosynthetic glyceraldehyde-3-phosphate dehydrogenase from… · the same entry in another collection · chain O against O, TM-score 1.00
  • P50362 · AlphaFold monomer V2.0 prediction for glyceraldehyde-3-phosphate dehydrogenase a… · a predicted model of the same protein · chain O against A, TM-score 0.99

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