MolNFT v1 · #99218 · protein
L(M196)H,H(M202)L double mutant structure of photosynthetic reaction center from rhodobacter sphaeroides strain rv
4LWY · Reaction center protein H chain: “L(M196)H,H(M202)L double mutant structure of photosynthetic reaction center from rhodobacter sphaeroides…”. X-ray diffraction, 9 ligands (UNL, BCL, BPH), 11 pockets (best druggability 0.82). MolNFT…
- PDB
- 4LWY
- Type
- protein
- Length
- 823 residues
- Chains
- 3
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Reaction center protein H chain; Reaction center protein L chain; Reaction center protein…
- UniProt
- P0C0Y7, P0C0Y8, P0C0Y9
- Ligands
- UNL, BCL, BPH, U10, CDL, SPN, K, FE, PO4
- Pockets
- 11 · best druggability 0.82
Structure
x-ray diffraction · 3 distinct chains · 51% helix, 10% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| H | Reaction center protein H chain | protein | 240 | 22% helix, 24% strand | P0C0Y7 |
| L | Reaction center protein L chain | protein | 281 | 63% helix, 4% strand | P0C0Y8 |
| M | Reaction center protein M chain | protein | 302 | 64% helix, 4% strand | P0C0Y9 |
Ligands and binding sites
- UNL · Unknown ligand · ligand · 11 copies · chains H, L, M
- BCL · Bacteriochlorophyll A · ligand · 3 copies · chains L, M
- BPH · Bacteriopheophytin A · ligand · 3 copies · chains L, M
- U10 · Ubiquinone-10 · ligand · 2 copies · chains L, M
- CDL · Cardiolipin · ligand · chains H, L, M
- SPN · Speroidenone · ligand · chains M
- K · Potassium ion · metal · chains H
- FE · Fe (III) ion · metal · chains L, M
- PO4 · Phosphate ion · ion · 3 copies · chains H, M
- EDO · 1,2-ethanediol · additive · 7 copies · chains H, L, M
- LDA · Lauryl dimethylamine-N-oxide · additive · 6 copies · chains H, M, L
- DIO · 1,4-diethylene dioxide · additive · 4 copies · chains H, L, M
- TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · 2 copies · chains H, L
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
11 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 1160 | 0.82 | 0.82 | 95 | BCL, BPH |
| 2 | 189 | 0.77 | 0.91 | 40 | U10 |
| 3 | 101 | 0.76 | 0.97 | 31 | empty |
| 4 | 123 | 0.63 | 0.87 | 28 | U10 |
| 5 | 105 | 0.58 | 0.85 | 20 | SPN |
Interfaces
3 interfaces between chains.
- L–M · 4597 Ų buried · 70 hydrogen bonds · protein-protein
- H–M · 2861 Ų buried · 39 hydrogen bonds · protein-protein
- H–L · 1634 Ų buried · 19 hydrogen bonds · protein-protein
Compared structures
- 4LWY · L(M196)H,H(M202)L Double Mutant Structure of Photosynthetic Reaction Center From… · the same entry in another collection · chain H against H, 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 P0C0Y7
- Every structure of UniProt P0C0Y8
- Every structure of UniProt P0C0Y9
- Elsewhere: RCSB PDB 4LWY · PDBe 4LWY · UniProt P0C0Y7 · UniProt P0C0Y8 · UniProt P0C0Y9
GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.