MolNFT v1 · #155817 · protein

Crystal structure of alcohol dehydrogenase 1 from artemisia annua in complex with NAD+

6LJH: “Crystal structure of alcohol dehydrogenase 1 from artemisia annua in complex with NAD+”. X-ray diffraction, 3 ligands (NAD, NA, ZN), 2 pockets (best druggability 0.74). MolNFT v1 #155817 on GenesisL1: 3D structure, binding sites and…

PDB: 6LJH
Type: protein
Length: 377 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Alcohol dehydrogenase 1
EC: 1.1.1.-
UniProt: A0A2U1Q018
Ligands: NAD, NA, ZN
Pockets: 2 · best druggability 0.74

Structure

x-ray diffraction · 1 distinct chain · 28% helix, 23% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Alcohol dehydrogenase 1 (EC 1.1.1.-)	protein	377	28% helix, 23% strand	A0A2U1Q018

Ligands and binding sites

NAD · Nicotinamide-adenine-dinucleotide · ligand · chains A
NA · Sodium ion · metal · 4 copies · chains A
ZN · Zinc ion · metal · 2 copies · chains A
GOL · Glycerol · additive · 4 copies · chains A

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

Pockets

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

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	882	0.74	0.78	73	NAD, GOL, NA
2	51	0.36	0.80	11	GOL

Compared structures

6LJH · Crystal structure of Alcohol dehydrogenase 1 from Artemisia annua in complex with NAD+ · 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 A0A2U1Q018
Elsewhere: RCSB PDB 6LJH · PDBe 6LJH · UniProt A0A2U1Q018

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