ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

Neuroligin-1

Intramolecular
Cysteine 172 and cysteine 181
Cysteine 362 and cysteine 373
Cysteine 532 and cysteine 566
Cysteine 117 and cysteine 153
A redox-regulated disulphide may form within Neuroligin-1 between cysteines 172 and 181.

Details

Redox score ?
88
PDB code
3vkf
Structure name
crystal structure of neurexin 1beta/neuroligin 1 complex
Structure deposition date
2011-11-15
Thiol separation (Å)
2
Half-sphere exposure sum ?
42
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q62765
Residue number A
172
Residue number B
181
Peptide name
Neuroligin-1

Ligandability

Cysteine 172 of Neuroligin-1

Cysteine 181 of Neuroligin-1

A redox-regulated disulphide may form within Neuroligin-1 between cysteines 362 and 373 (339 and 350 respectively in this structure).

Details

Redox score ?
83
PDB code
5oj6
Structure name
crystal structure of the chicken mdga1 ectodomain in complex with the human neuroligin 1 (nl1(-a-b)) cholinesterase domain
Structure deposition date
2017-07-20
Thiol separation (Å)
2
Half-sphere exposure sum ?
54
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8N2Q7
Residue number A
362
Residue number B
373
Peptide name
Neuroligin-1

Ligandability

Cysteine 362 of Neuroligin-1

Cysteine 373 of Neuroligin-1

A redox-regulated disulphide may form within Neuroligin-1 between cysteines 532 and 566 (509 and 543 respectively in this structure).

Details

Redox score ?
82
PDB code
5ojk
Structure name
crystal structure of the human neuroligin 1 cholinesterase domain containing spliced sequence b (ssb) (nl1(-a+b))
Structure deposition date
2017-07-21
Thiol separation (Å)
2
Half-sphere exposure sum ?
68
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8N2Q7
Residue number A
532
Residue number B
566
Peptide name
Neuroligin-1

Ligandability

Cysteine 532 of Neuroligin-1

Cysteine 566 of Neuroligin-1

A redox-regulated disulphide may form within Neuroligin-1 between cysteines 117 and 153.

Details

Redox score ?
81
PDB code
5ojk
Structure name
crystal structure of the human neuroligin 1 cholinesterase domain containing spliced sequence b (ssb) (nl1(-a+b))
Structure deposition date
2017-07-21
Thiol separation (Å)
2
Half-sphere exposure sum ?
85
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8N2Q7
Residue number A
117
Residue number B
153
Peptide name
Neuroligin-1

Ligandability

Cysteine 117 of Neuroligin-1

Cysteine 153 of Neuroligin-1

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