Research workbench
Crystal structure of GAPDH/CP12/PRK complex from arabidopsis thaliana
Analyse Crystal structure of GAPDH/CP12/PRK complex from arabidopsis thaliana in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.
- PDB
- 6KEZ
- Type
- protein
- Length
- 4,345 residues
- Chains
- 16
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Glyceraldehyde-3-phosphate dehydrogenase GAPA1; Phosphoribulokinase; Calvin cycle protein…
- EC
- 1.2.1.13, 2.7.1.19
- UniProt
- P25856, P25697, Q9LZP9
- Ligands
- NAD
- Pockets
- 20 · best druggability 0.83
Structure
x-ray diffraction · 5 distinct chains · 36% helix, 23% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B, C, E, F, G, H | Glyceraldehyde-3-phosphate dehydrogenase GAPA1 (EC 1.2.1.13) | protein | 336 | 31% helix, 28% strand | P25856 |
| D | Glyceraldehyde-3-phosphate dehydrogenase GAPA1 (EC 1.2.1.13) | protein | 335 | 28% helix, 28% strand | P25856 |
| I, K, J, L | Phosphoribulokinase (EC 2.7.1.19) | protein | 342 | 35% helix, 25% strand | P25697 |
| M, N | Calvin cycle protein CP12-2 | protein | 73 | 70% helix, 0% strand | Q9LZP9 |
| O, P | Calvin cycle protein CP12-2 | protein | 72 | 72% helix, 0% strand | Q9LZP9 |
Ligands and binding sites
- NAD · Nicotinamide-adenine-dinucleotide · ligand · 8 copies · chains A, D, P, B, C, O, E, H, M, F, G, N
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
20 pockets found on a 1 Å grid, 20 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 1033 | 0.83 | 0.84 | 107 | NAD |
| 2 | 1091 | 0.83 | 0.84 | 118 | NAD |
| 3 | 1023 | 0.82 | 0.84 | 102 | empty |
| 4 | 709 | 0.81 | 0.85 | 78 | empty |
| 5 | 912 | 0.81 | 0.83 | 103 | empty |
Interfaces
34 interfaces between chains.
- A–C · 1991 Ų buried · 16 hydrogen bonds · protein-protein
- E–G · 1979 Ų buried · 25 hydrogen bonds · protein-protein
- B–D · 1963 Ų buried · 29 hydrogen bonds · protein-protein
- F–H · 1960 Ų buried · 30 hydrogen bonds · protein-protein
- F–G · 1400 Ų buried · 15 hydrogen bonds · protein-protein
Modifications
Observed in the structure: 15 disulfide (disulfide).
Compared structures
- 6KEZ · Crystal structure of GAPDH/CP12/PRK complex from Arabidopsis thaliana · the same entry in another collection · chain J against J, TM-score 1.00
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt P25856
- Every structure of UniProt P25697
- Every structure of UniProt Q9LZP9
- Elsewhere: RCSB PDB 6KEZ · PDBe 6KEZ · UniProt P25856 · UniProt P25697 · UniProt Q9LZP9
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