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Crystal structure of aureusimine biosynthetic cluster reductase domain

Analyse Crystal structure of aureusimine biosynthetic cluster reductase domain in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB: 4F6L
Type: protein
Length: 748 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Ausa reductase domain protein
UniProt: Q99X42
Pockets: 6 · best druggability 0.80

Structure

x-ray diffraction · 2 distinct chains · 41% helix, 18% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
B	Ausa reductase domain protein	protein	370	42% helix, 19% strand	Q99X42
A	Ausa reductase domain protein	protein	378	39% helix, 17% strand	Q99X42

Pockets

6 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	1084	0.80	0.82	96	empty
2	1058	0.76	0.78	86	empty
3	395	0.68	0.80	37	empty
4	102	0.50	0.82	21	empty
5	148	0.45	0.77	33	empty

Interfaces

1 interface between chains.

B–A · 821 Å² buried · 8 hydrogen bonds · protein-protein

Compared structures

4F6L · Crystal structure of Aureusimine biosynthetic cluster reductase domain · the same entry in another collection · chain B against B, 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 Q99X42
Elsewhere: RCSB PDB 4F6L · PDBe 4F6L · UniProt Q99X42

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