ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

Killer cell lectin-like receptor subfamily B member 1A

Intramolecular
Cysteine 195 and cysteine 208
Cysteine 100 and cysteine 111
Cysteine 128 and cysteine 216
Cysteine 111 and cysteine 216
A redox-regulated disulphide may form within Killer cell lectin-like receptor subfamily B member 1A between cysteines 195 and 208 (101 and 114 respectively in this structure).

Details

Redox score ?
85
PDB code
2m94
Structure name
nmr structure of the lymphocyte receptor nkr-p1a
Structure deposition date
2013-05-31
Thiol separation (Å)
2
Half-sphere exposure sum ?
72
Minimum pKa ?
nan
% buried
nan
Peptide accession
G5E882
Residue number A
195
Residue number B
208
Peptide name
Killer cell lectin-like receptor subfamily B member 1A

Ligandability

Cysteine 195 of Killer cell lectin-like receptor subfamily B member 1A

Cysteine 208 of Killer cell lectin-like receptor subfamily B member 1A

A redox-regulated disulphide may form within Killer cell lectin-like receptor subfamily B member 1A between cysteines 100 and 111 (6 and 17 respectively in this structure).

Details

Redox score ?
84
PDB code
2mti
Structure name
nmr structure of the lymphocyte receptor nkr-p1a
Structure deposition date
2014-08-19
Thiol separation (Å)
2
Half-sphere exposure sum ?
63
Minimum pKa ?
nan
% buried
nan
Peptide accession
G5E882
Residue number A
100
Residue number B
111
Peptide name
Killer cell lectin-like receptor subfamily B member 1A

Ligandability

Cysteine 100 of Killer cell lectin-like receptor subfamily B member 1A

Cysteine 111 of Killer cell lectin-like receptor subfamily B member 1A

A redox-regulated disulphide may form within Killer cell lectin-like receptor subfamily B member 1A between cysteines 128 and 216 (34 and 122 respectively in this structure).

Details

Redox score ?
82
PDB code
2m94
Structure name
nmr structure of the lymphocyte receptor nkr-p1a
Structure deposition date
2013-05-31
Thiol separation (Å)
2
Half-sphere exposure sum ?
76
Minimum pKa ?
nan
% buried
nan
Peptide accession
G5E882
Residue number A
128
Residue number B
216
Peptide name
Killer cell lectin-like receptor subfamily B member 1A

Ligandability

Cysteine 128 of Killer cell lectin-like receptor subfamily B member 1A

Cysteine 216 of Killer cell lectin-like receptor subfamily B member 1A

A redox-regulated disulphide may form within Killer cell lectin-like receptor subfamily B member 1A between cysteines 111 and 216 (17 and 122 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
32
PDB code
2mti
Structure name
nmr structure of the lymphocyte receptor nkr-p1a
Structure deposition date
2014-08-19
Thiol separation (Å)
10
Half-sphere exposure sum ?
84
Minimum pKa ?
nan
% buried
nan
Peptide accession
G5E882
Residue number A
111
Residue number B
216
Peptide name
Killer cell lectin-like receptor subfamily B member 1A

Ligandability

Cysteine 111 of Killer cell lectin-like receptor subfamily B member 1A

Cysteine 216 of Killer cell lectin-like receptor subfamily B member 1A

If this tool was useful for finding a disulphide, please cite: