MolNFT v1 · #158378 · protein

Crystal structure of fungal lipoxygenase from fusarium graminearum. I222 crystal form.

6NS3: “Crystal structure of fungal lipoxygenase from fusarium graminearum. I222 crystal form.”. X-ray diffraction, 1 ligand (FE2), 8 pockets (best druggability 0.59). MolNFT v1 #158378 on GenesisL1: 3D structure, binding sites and pockets…

PDB: 6NS3
Type: protein
Length: 633 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Lipoxygenase
EC: 1.13.11.-
UniProt: I1REW2
Ligands: FE2
Pockets: 8 · best druggability 0.59

Structure

x-ray diffraction · 1 distinct chain · 51% helix, 9% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Lipoxygenase (EC 1.13.11.-)	protein	633	51% helix, 9% strand	I1REW2

Ligands and binding sites

FE2 · Fe (II) ion · metal · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

8 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	208	0.59	0.81	20	empty
2	255	0.57	0.78	25	empty
3	98	0.51	0.83	26	empty
4	93	0.46	0.80	22	empty
5	93	0.43	0.79	26	empty

Compared structures

6NS3 · Crystal structure of fungal lipoxygenase from Fusarium graminearum. I222 crystal form. · 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 I1REW2
Elsewhere: RCSB PDB 6NS3 · PDBe 6NS3 · UniProt I1REW2

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