MolNFT v1 · #152943 · protein
X-ray sequence and high resolution crystal structure of persian sturgeon methemoglobin
6IYH · Alpha chain: “X-ray sequence and high resolution crystal structure of persian sturgeon methemoglobin”. X-ray diffraction, 1 ligand (HEM), 3 pockets (best druggability 0.73). MolNFT v1 #152943 on GenesisL1: 3D structure, binding…
- PDB
- 6IYH
- Type
- protein
- Length
- 287 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Alpha chain; Beta chain
- Ligands
- HEM
- Pockets
- 3 · best druggability 0.73
Structure
x-ray diffraction · 2 distinct chains · 80% helix, 0% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Alpha chain | protein | 142 | 80% helix, 0% strand | — |
| B | Beta chain | protein | 145 | 80% helix, 0% strand | — |
Ligands and binding sites
- HEM · Protoporphyrin IX containing Fe · ligand · 2 copies · chains A, B
- PGO · S-1,2-propanediol · additive · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
3 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 209 | 0.73 | 0.88 | 25 | HEM |
| 2 | 222 | 0.72 | 0.87 | 27 | HEM |
| 3 | 163 | 0.47 | 0.76 | 25 | PGO |
Interfaces
1 interface between chains.
- A–B · 910 Ų buried · 6 hydrogen bonds · protein-protein
Compared structures
- 6IYH · X-ray sequence and high resolution crystal structure of Persian sturgeon methemoglobin · the same entry in another collection · chain A against A, 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
- Elsewhere: RCSB PDB 6IYH · PDBe 6IYH
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