Pantetheinase
Intramolecular
Cysteine 145 and cysteine 152
Cysteine 403 and cysteine 411
Cysteine 109 and cysteine 126
Cysteine 363 and cysteine 398
Cysteine 357 and cysteine 362
Cysteine 362 and cysteine 363
Cysteine 357 and cysteine 363
Cysteine 357 and cysteine 398
Cysteine 362 and cysteine 398
7slx A 124 A 131
A redox-regulated disulphide may form within Pantetheinase between cysteines 145 and 152 (124 and 131 respectively in this structure).
Details
Redox score ?
88
PDB code
7slx
Structure name
vanin-1 complexed with compound 11
Structure deposition date
2021-10-25
Thiol separation (Å)
2
Half-sphere exposure sum ?
37
Minimum pKa ?
nan
% buried
nan
Peptide accession
O95497
Residue number A
145
Residue number B
152
Peptide name
Pantetheinase
Ligandability
Cysteine 145 of Pantetheinase
Cysteine 152 of Pantetheinase
7slv A 382 A 390
A redox-regulated disulphide may form within Pantetheinase between cysteines 403 and 411 (382 and 390 respectively in this structure).
Details
Redox score ?
82
PDB code
7slv
Structure name
vanin-1 complexed with compound 3
Structure deposition date
2021-10-25
Thiol separation (Å)
2
Half-sphere exposure sum ?
80
Minimum pKa ?
nan
% buried
nan
Peptide accession
O95497
Residue number A
403
Residue number B
411
Peptide name
Pantetheinase
Ligandability
Cysteine 403 of Pantetheinase
Cysteine 411 of Pantetheinase
4cyy A 109 A 126
A redox-regulated disulphide may form within Pantetheinase between cysteines 109 and 126.
Details
Redox score ?
81
PDB code
4cyy
Structure name
the structure of vanin-1: defining the link between metabolic disease, oxidative stress and inflammation
Structure deposition date
2014-04-16
Thiol separation (Å)
2
Half-sphere exposure sum ?
60
Minimum pKa ?
nan
% buried
nan
Peptide accession
O95497
Residue number A
109
Residue number B
126
Peptide name
Pantetheinase
Ligandability
Cysteine 109 of Pantetheinase
Cysteine 126 of Pantetheinase
4cyg B 363 B 398
A redox-regulated disulphide may form within Pantetheinase between cysteines 363 and 398.
Details
Redox score ?
78
PDB code
4cyg
Structure name
the structure of vanin-1: defining the link between metabolic disease, oxidative stress and inflammation
Structure deposition date
2014-04-11
Thiol separation (Å)
2
Half-sphere exposure sum ?
102
Minimum pKa ?
nan
% buried
nan
Peptide accession
O95497
Residue number A
363
Residue number B
398
Peptide name
Pantetheinase
Ligandability
Cysteine 363 of Pantetheinase
Cysteine 398 of Pantetheinase
4cyy A 357 A 362
A redox-regulated disulphide may form within Pantetheinase between cysteines 357 and 362.
Details
Redox score ?
73
PDB code
4cyy
Structure name
the structure of vanin-1: defining the link between metabolic disease, oxidative stress and inflammation
Structure deposition date
2014-04-16
Thiol separation (Å)
3
Half-sphere exposure sum ?
77
Minimum pKa ?
9
% buried
40
Peptide accession
O95497
Residue number A
357
Residue number B
362
Peptide name
Pantetheinase
Ligandability
Cysteine 357 of Pantetheinase
Cysteine 362 of Pantetheinase
7slx A 341 A 342
A redox-regulated disulphide may form within Pantetheinase between cysteines 362 and 363 (341 and 342 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?
Details
Redox score ?
45
PDB code
7slx
Structure name
vanin-1 complexed with compound 11
Structure deposition date
2021-10-25
Thiol separation (Å)
7
Half-sphere exposure sum ?
92
Minimum pKa ?
nan
% buried
nan
Peptide accession
O95497
Residue number A
362
Residue number B
363
Peptide name
Pantetheinase
Ligandability
Cysteine 362 of Pantetheinase
Cysteine 363 of Pantetheinase
4cyy A 357 A 363
A redox-regulated disulphide may form within Pantetheinase between cysteines 357 and 363. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?
Details
Redox score ?
42
PDB code
4cyy
Structure name
the structure of vanin-1: defining the link between metabolic disease, oxidative stress and inflammation
Structure deposition date
2014-04-16
Thiol separation (Å)
7
Half-sphere exposure sum ?
88
Minimum pKa ?
12
% buried
nan
Peptide accession
O95497
Residue number A
357
Residue number B
363
Peptide name
Pantetheinase
Ligandability
Cysteine 357 of Pantetheinase
Cysteine 363 of Pantetheinase
4cyf A 357 A 398
A redox-regulated disulphide may form within Pantetheinase between cysteines 357 and 398. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?
Details
Redox score ?
38
PDB code
4cyf
Structure name
the structure of vanin-1: defining the link between metabolic disease, oxidative stress and inflammation
Structure deposition date
2014-04-11
Thiol separation (Å)
9
Half-sphere exposure sum ?
88
Minimum pKa ?
nan
% buried
nan
Peptide accession
O95497
Residue number A
357
Residue number B
398
Peptide name
Pantetheinase
Ligandability
Cysteine 357 of Pantetheinase
Cysteine 398 of Pantetheinase
4cyf A 362 A 398
A redox-regulated disulphide may form within Pantetheinase between cysteines 362 and 398. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?
Details
Redox score ?
37
PDB code
4cyf
Structure name
the structure of vanin-1: defining the link between metabolic disease, oxidative stress and inflammation
Structure deposition date
2014-04-11
Thiol separation (Å)
8
Half-sphere exposure sum ?
92
Minimum pKa ?
nan
% buried
nan
Peptide accession
O95497
Residue number A
362
Residue number B
398
Peptide name
Pantetheinase
Ligandability
Cysteine 362 of Pantetheinase
Cysteine 398 of Pantetheinase
If this tool was useful for finding a disulphide, please cite: