MolNFT v1 · #32157 · protein
Pea light-harvesting complex II at 2.5 ångström resolution
2BHW · Chlorophyll a-B binding protein AB80: “Pea light-harvesting complex II at 2.5 ångström resolution”. X-ray diffraction, 7 ligands (CLA, CHL, LUX), 19 pockets (best druggability 0.58). MolNFT v1 #32157 on GenesisL1: 3D structure…
- PDB
- 2BHW
- Type
- protein
- Length
- 669 residues
- Chains
- 3
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Chlorophyll a-B binding protein AB80
- UniProt
- P07371
- Ligands
- CLA, CHL, LUX, NEX, XAT, LHG, DGD
- Pockets
- 19 · best druggability 0.58
Structure
x-ray diffraction · 1 distinct chain · 50% helix, 4% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A, B, C | Chlorophyll a-B binding protein AB80 | protein | 223 | 50% helix, 4% strand | P07371 |
Ligands and binding sites
- CLA · Chlorophyll A · ligand · 24 copies · chains A, C, B
- CHL · Chlorophyll B · ligand · 18 copies · chains A, C, B
- LUX · (3R,3'R,6'S,9R,9'R,13R,13'S)-4',5'-didehydro-5',6',7', 8',9,9',10,10',11,11',12,12',13,13',14,14',15,15'-octadecahydro-beta,beta-carotene-3,3'-diol · ligand · 6 copies · chains A, B, C
- NEX · (1R,3R)-6-{(3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1S,4R, 6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13, 15,17-nonaenylidene}-1,5,5-trimethylcyclohexane-1,3-diol · ligand · 3 copies · chains A, B, C
- XAT · (3S,5R,6S,3'S,5'R,6'S)-5,6,5',6'-diepoxy-5,6,5',6'-tetrahydro-beta,beta-carotene-3,3'-diol · ligand · 3 copies · chains A, C, B
- LHG · 1,2-dipalmitoyl-phosphatidyl-glycerole · ligand · 3 copies · chains A, B, C
- DGD · Digalactosyl diacyl glycerol (dgdg) · ligand · 3 copies · chains A, B, C
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
19 pockets found on a 1 Å grid, 10 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 313 | 0.58 | 0.76 | 33 | CLA, CHL |
| 2 | 240 | 0.57 | 0.79 | 25 | empty |
| 3 | 287 | 0.57 | 0.77 | 33 | CLA, CHL |
| 4 | 246 | 0.57 | 0.78 | 24 | CLA |
| 5 | 326 | 0.55 | 0.75 | 35 | CLA, CHL |
Interfaces
3 interfaces between chains.
- A–B · 777 Ų buried · 5 hydrogen bonds · protein-protein
- B–C · 774 Ų buried · 5 hydrogen bonds · protein-protein
- A–C · 774 Ų buried · 5 hydrogen bonds · protein-protein
Compared structures
- 2BHW · Pea light-harvesting complex II at 2.5 ångström resolution · the same entry in another collection · chain A against A, TM-score 1.00
- P07371 · AlphaFold monomer V2.0 prediction for chlorophyll a-B binding protein AB80, chloroplastic… · a predicted model of the same protein · chain C against A, TM-score 0.99
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 P07371
- Elsewhere: RCSB PDB 2BHW · PDBe 2BHW · UniProt P07371
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