MolNFT v1 · #31066 · protein

1H-NMR solution structure of a TRYPSIN/CHYMOTRYPSIN bowman-birk inhibitor from lens culinaris.

2AIH · Bowman-birk type protease inhibitor, lcti: “1H-NMR solution structure of a TRYPSIN/CHYMOTRYPSIN bowman-birk inhibitor from lens culinaris.”. Solution nmr, 1 ligand (CL), 1 pocket (best druggability 0.72). MolNFT v1 #31066 on…

PDB: 2AIH
Type: protein
Length: 67 residues
Chains: 1
Method: solution nmr
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Bowman-birk type protease inhibitor, lcti
UniProt: Q8W4Y8
Ligands: CL
Pockets: 1 · best druggability 0.72

Structure

solution nmr · 1 distinct chain · 0% helix, 24% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	Bowman-birk type protease inhibitor, lcti	protein	67	0% helix, 24% strand	Q8W4Y8

Ligands and binding sites

CL · Chloride ion · ion · 11 copies · 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	94	0.72	0.95	24	CL

Modifications

Observed in the structure: 7 disulfide (disulfide).

Compared structures

2AIH · 1H-NMR solution structure of a trypsin/chymotrypsin Bowman-Birk inhibitor from Lens… · the same entry in another collection · chain A against A, TM-score 1.00
Q8W4Y8 · AlphaFold monomer V2.0 prediction for bowman-birk type proteinase inhibitor (Q8W4Y8) · a predicted model of the same protein · chain A against A, TM-score 0.67

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 Q8W4Y8
Elsewhere: RCSB PDB 2AIH · PDBe 2AIH · UniProt Q8W4Y8

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