MolNFT v1 · #157822 · protein

Structure of aedes aegypti OBP22 in the complex with arachidonic acid

6NBN · AAEL005772-pa: “Structure of aedes aegypti OBP22 in the complex with arachidonic acid”. Solution nmr, 1 ligand (ACD), 1 pocket (best druggability 0.79). MolNFT v1 #157822 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB: 6NBN
Type: protein
Length: 123 residues
Chains: 1
Method: solution nmr
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: AAEL005772-pa
UniProt: Q1HRL7
Ligands: ACD
Pockets: 1 · best druggability 0.79

Structure

solution nmr · 1 distinct chain · 61% helix, 3% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	AAEL005772-pa	protein	123	61% helix, 3% strand	Q1HRL7

Ligands and binding sites

ACD · Arachidonic acid · ligand · chains A

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

Pockets

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

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	226	0.79	0.92	33	ACD

Modifications

Observed in the structure: 3 disulfide (disulfide).

Compared structures

6NBN · Structure of Aedes aegypti OBP22 in the complex with arachidonic acid · 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 Q1HRL7
Elsewhere: RCSB PDB 6NBN · PDBe 6NBN · UniProt Q1HRL7

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