MolNFT v1 · #176727 · protein
Crystal structure of apo (heme-free) pefr
7DVS · Marr family transcriptional regulator: “Crystal structure of apo (heme-free) pefr”. X-ray diffraction, 2 pockets (best druggability 0.76). MolNFT v1 #176727 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 7DVS
- Type
- protein
- Length
- 502 residues
- Chains
- 4
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Marr family transcriptional regulator
- UniProt
- R4Z9I5
- Pockets
- 2 · best druggability 0.76
Structure
x-ray diffraction · 4 distinct chains · 64% helix, 9% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Marr family transcriptional regulator | protein | 139 | 68% helix, 9% strand | R4Z9I5 |
| B | Marr family transcriptional regulator | protein | 138 | 66% helix, 9% strand | R4Z9I5 |
| C | Marr family transcriptional regulator | protein | 116 | 63% helix, 10% strand | R4Z9I5 |
| D | Marr family transcriptional regulator | protein | 109 | 56% helix, 10% strand | R4Z9I5 |
Pockets
2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 965 | 0.76 | 0.78 | 68 | empty |
| 2 | 113 | 0.39 | 0.74 | 24 | empty |
Interfaces
3 interfaces between chains.
- A–B · 1427 Ų buried · 10 hydrogen bonds · protein-protein
- C–D · 564 Ų buried · 2 hydrogen bonds · protein-protein
- A–C · 464 Ų buried · 4 hydrogen bonds · protein-protein
Compared structures
- 7DVS · Crystal structure of Apo (heme-free) PefR · 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
- Every structure of UniProt R4Z9I5
- Elsewhere: RCSB PDB 7DVS · PDBe 7DVS · UniProt R4Z9I5
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