ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

PRSS3 protein

Intermolecular
Cysteine 68 and cysteine 343 of Amyloid beta precursor like protein 2
Cysteine 52 and cysteine 343 of Amyloid beta precursor like protein 2
Cysteine 68 and cysteine 319 of Amyloid beta precursor like protein 2
Cysteine 52 and cysteine 472 of Amyloid-beta A4 protein
Cysteine 68 and cysteine 300 of Amyloid-beta precursor protein
Cysteine 68 and cysteine 222 of Amyloid-beta A4 protein
Cysteine 68 and cysteine 49 of Pancreatic trypsin inhibitor
Cysteine 200 and cysteine 34 of Amyloid-beta A4 protein
Cysteine 52 and cysteine 319 of Amyloid beta precursor like protein 2
Cysteine 224 and cysteine 34 of Amyloid-beta A4 protein
More...
Cysteine 52 and cysteine 49 of Pancreatic trypsin inhibitor
Cysteine 68 and cysteine 324 of Amyloid-beta precursor protein
Cysteine 52 and cysteine 222 of Amyloid-beta A4 protein
Cysteine 52 and cysteine 300 of Amyloid-beta precursor protein
Cysteine 52 and cysteine 34 of Amyloid-beta A4 protein
Cysteine 200 and cysteine 472 of Amyloid-beta A4 protein
Intramolecular
Cysteine 143 and cysteine 210
Cysteine 34 and cysteine 164
Cysteine 175 and cysteine 189
Cysteine 52 and cysteine 68
Cysteine 200 and cysteine 224
A redox-regulated disulphide may form between cysteine 68 of PRSS3 protein and cysteine 343 of Amyloid beta precursor like protein 2 (58 and 38 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
5jbt
Structure name
mesotrypsin in complex with cleaved amyloid precursor like protein 2 inhibitor (aplp2)
Structure deposition date
2016-04-13
Thiol separation (Å)
8
Half-sphere exposure sum ?
78
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid beta precursor like protein 2
Peptide A accession
Q8N2U3
Peptide B accession
Q06481
Peptide A residue number
68
Peptide B residue number
343

Ligandability

Cysteine 68 of PRSS3 protein

Cysteine 343 of Amyloid beta precursor like protein 2

A redox-regulated disulphide may form between cysteine 52 of PRSS3 protein and cysteine 343 of Amyloid beta precursor like protein 2 (42 and 38 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
41
PDB code
5jbt
Structure name
mesotrypsin in complex with cleaved amyloid precursor like protein 2 inhibitor (aplp2)
Structure deposition date
2016-04-13
Thiol separation (Å)
9
Half-sphere exposure sum ?
77
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid beta precursor like protein 2
Peptide A accession
Q8N2U3
Peptide B accession
Q06481
Peptide A residue number
52
Peptide B residue number
343

Ligandability

Cysteine 52 of PRSS3 protein

Cysteine 343 of Amyloid beta precursor like protein 2

A redox-regulated disulphide may form between cysteine 68 of PRSS3 protein and cysteine 319 of Amyloid beta precursor like protein 2 (58 and 14 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
41
PDB code
5jbt
Structure name
mesotrypsin in complex with cleaved amyloid precursor like protein 2 inhibitor (aplp2)
Structure deposition date
2016-04-13
Thiol separation (Å)
8
Half-sphere exposure sum ?
88
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid beta precursor like protein 2
Peptide A accession
Q8N2U3
Peptide B accession
Q06481
Peptide A residue number
68
Peptide B residue number
319

Ligandability

Cysteine 68 of PRSS3 protein

Cysteine 319 of Amyloid beta precursor like protein 2

A redox-regulated disulphide may form between cysteine 52 of PRSS3 protein and cysteine 472 of Amyloid-beta A4 protein (42 and 17 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
41
PDB code
6har
Structure name
crystal structure of mesotrypsin in complex with appi-m17c/i18f/f34c
Structure deposition date
2018-08-08
Thiol separation (Å)
8
Half-sphere exposure sum ?
97
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid-beta A4 protein
Peptide A accession
Q8N2U3
Peptide B accession
H7C0V9
Peptide A residue number
52
Peptide B residue number
472

Ligandability

Cysteine 52 of PRSS3 protein

Cysteine 472 of Amyloid-beta A4 protein

Uncertain whether structure cysteine 17 has been assigned to correct residue.
A redox-regulated disulphide may form between cysteine 68 of PRSS3 protein and cysteine 300 of Amyloid-beta precursor protein (58 and 14 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
41
PDB code
6gfi
Structure name
structure of human mesotrypsin in complex with appi variant t11v/m17r/i18f/f34v
Structure deposition date
2018-04-30
Thiol separation (Å)
9
Half-sphere exposure sum ?
94
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid-beta precursor protein
Peptide A accession
Q8N2U3
Peptide B accession
P05067
Peptide A residue number
68
Peptide B residue number
300

Ligandability

Cysteine 68 of PRSS3 protein

Cysteine 300 of Amyloid-beta precursor protein

A redox-regulated disulphide may form between cysteine 68 of PRSS3 protein and cysteine 222 of Amyloid-beta A4 protein (58 and 14 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
40
PDB code
6har
Structure name
crystal structure of mesotrypsin in complex with appi-m17c/i18f/f34c
Structure deposition date
2018-08-08
Thiol separation (Å)
9
Half-sphere exposure sum ?
95
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid-beta A4 protein
Peptide A accession
Q8N2U3
Peptide B accession
H7C0V9
Peptide A residue number
68
Peptide B residue number
222

Ligandability

Cysteine 68 of PRSS3 protein

Cysteine 222 of Amyloid-beta A4 protein

A redox-regulated disulphide may form between cysteine 68 of PRSS3 protein and cysteine 49 of Pancreatic trypsin inhibitor (58 and 14 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
40
PDB code
3p92
Structure name
human mesotrypsin complexed with bovine pancreatic trypsin inhibitor variant (bpti-k15r/r17g)
Structure deposition date
2010-10-15
Thiol separation (Å)
9
Half-sphere exposure sum ?
93
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Pancreatic trypsin inhibitor
Peptide A accession
Q8N2U3
Peptide B accession
P00974
Peptide A residue number
68
Peptide B residue number
49

Ligandability

Cysteine 68 of PRSS3 protein

Cysteine 49 of Pancreatic trypsin inhibitor

A redox-regulated disulphide may form between cysteine 200 of PRSS3 protein and cysteine 34 of Amyloid-beta A4 protein (191 and 34 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
38
PDB code
6har
Structure name
crystal structure of mesotrypsin in complex with appi-m17c/i18f/f34c
Structure deposition date
2018-08-08
Thiol separation (Å)
8
Half-sphere exposure sum ?
100
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid-beta A4 protein
Peptide A accession
Q8N2U3
Peptide B accession
H7C0V9
Peptide A residue number
200
Peptide B residue number
34

Ligandability

Cysteine 200 of PRSS3 protein

Cysteine 34 of Amyloid-beta A4 protein

Cysteine 34 in protein B could not be asigned to a Uniprot residue.
A redox-regulated disulphide may form between cysteine 52 of PRSS3 protein and cysteine 319 of Amyloid beta precursor like protein 2 (42 and 14 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
37
PDB code
5jbt
Structure name
mesotrypsin in complex with cleaved amyloid precursor like protein 2 inhibitor (aplp2)
Structure deposition date
2016-04-13
Thiol separation (Å)
9
Half-sphere exposure sum ?
87
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid beta precursor like protein 2
Peptide A accession
Q8N2U3
Peptide B accession
Q06481
Peptide A residue number
52
Peptide B residue number
319

Ligandability

Cysteine 52 of PRSS3 protein

Cysteine 319 of Amyloid beta precursor like protein 2

A redox-regulated disulphide may form between cysteine 224 of PRSS3 protein and cysteine 34 of Amyloid-beta A4 protein (220 and 34 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
36
PDB code
6har
Structure name
crystal structure of mesotrypsin in complex with appi-m17c/i18f/f34c
Structure deposition date
2018-08-08
Thiol separation (Å)
10
Half-sphere exposure sum ?
83
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid-beta A4 protein
Peptide A accession
Q8N2U3
Peptide B accession
H7C0V9
Peptide A residue number
224
Peptide B residue number
34

Ligandability

Cysteine 224 of PRSS3 protein

Cysteine 34 of Amyloid-beta A4 protein

Cysteine 34 in protein B could not be asigned to a Uniprot residue.
A redox-regulated disulphide may form between cysteine 52 of PRSS3 protein and cysteine 49 of Pancreatic trypsin inhibitor (42 and 14 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
36
PDB code
4dg4
Structure name
human mesotrypsin-s39y complexed with bovine pancreatic trypsin inhibitor (bpti)
Structure deposition date
2012-01-24
Thiol separation (Å)
9
Half-sphere exposure sum ?
96
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Pancreatic trypsin inhibitor
Peptide A accession
Q8N2U3
Peptide B accession
P00974
Peptide A residue number
52
Peptide B residue number
49

Ligandability

Cysteine 52 of PRSS3 protein

Cysteine 49 of Pancreatic trypsin inhibitor

A redox-regulated disulphide may form between cysteine 68 of PRSS3 protein and cysteine 324 of Amyloid-beta precursor protein (58 and 38 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
36
PDB code
6gfi
Structure name
structure of human mesotrypsin in complex with appi variant t11v/m17r/i18f/f34v
Structure deposition date
2018-04-30
Thiol separation (Å)
10
Half-sphere exposure sum ?
86
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid-beta precursor protein
Peptide A accession
Q8N2U3
Peptide B accession
P05067
Peptide A residue number
68
Peptide B residue number
324

Ligandability

Cysteine 68 of PRSS3 protein

Cysteine 324 of Amyloid-beta precursor protein

A redox-regulated disulphide may form between cysteine 52 of PRSS3 protein and cysteine 222 of Amyloid-beta A4 protein (42 and 14 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
35
PDB code
6har
Structure name
crystal structure of mesotrypsin in complex with appi-m17c/i18f/f34c
Structure deposition date
2018-08-08
Thiol separation (Å)
9
Half-sphere exposure sum ?
100
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid-beta A4 protein
Peptide A accession
Q8N2U3
Peptide B accession
H7C0V9
Peptide A residue number
52
Peptide B residue number
222

Ligandability

Cysteine 52 of PRSS3 protein

Cysteine 222 of Amyloid-beta A4 protein

A redox-regulated disulphide may form between cysteine 52 of PRSS3 protein and cysteine 300 of Amyloid-beta precursor protein (42 and 14 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
35
PDB code
6gfi
Structure name
structure of human mesotrypsin in complex with appi variant t11v/m17r/i18f/f34v
Structure deposition date
2018-04-30
Thiol separation (Å)
9
Half-sphere exposure sum ?
96
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid-beta precursor protein
Peptide A accession
Q8N2U3
Peptide B accession
P05067
Peptide A residue number
52
Peptide B residue number
300

Ligandability

Cysteine 52 of PRSS3 protein

Cysteine 300 of Amyloid-beta precursor protein

A redox-regulated disulphide may form between cysteine 52 of PRSS3 protein and cysteine 34 of Amyloid-beta A4 protein (42 and 34 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
35
PDB code
6har
Structure name
crystal structure of mesotrypsin in complex with appi-m17c/i18f/f34c
Structure deposition date
2018-08-08
Thiol separation (Å)
10
Half-sphere exposure sum ?
94
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid-beta A4 protein
Peptide A accession
Q8N2U3
Peptide B accession
H7C0V9
Peptide A residue number
52
Peptide B residue number
34

Ligandability

Cysteine 52 of PRSS3 protein

Cysteine 34 of Amyloid-beta A4 protein

Cysteine 34 in protein B could not be asigned to a Uniprot residue.
A redox-regulated disulphide may form between cysteine 200 of PRSS3 protein and cysteine 472 of Amyloid-beta A4 protein (191 and 17 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
28
PDB code
6har
Structure name
crystal structure of mesotrypsin in complex with appi-m17c/i18f/f34c
Structure deposition date
2018-08-08
Thiol separation (Å)
10
Half-sphere exposure sum ?
103
Minimum pKa ?
nan
% buried
nan
Peptide A name
PRSS3 protein
Peptide B name
Amyloid-beta A4 protein
Peptide A accession
Q8N2U3
Peptide B accession
H7C0V9
Peptide A residue number
200
Peptide B residue number
472

Ligandability

Cysteine 200 of PRSS3 protein

Cysteine 472 of Amyloid-beta A4 protein

Uncertain whether structure cysteine 17 has been assigned to correct residue.
A redox-regulated disulphide may form within PRSS3 protein between cysteines 143 and 210 (136 and 201 respectively in this structure).

Details

Redox score ?
87
PDB code
6har
Structure name
crystal structure of mesotrypsin in complex with appi-m17c/i18f/f34c
Structure deposition date
2018-08-08
Thiol separation (Å)
2
Half-sphere exposure sum ?
62
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8N2U3
Residue number A
143
Residue number B
210
Peptide name
PRSS3 protein

Ligandability

Cysteine 143 of PRSS3 protein

Cysteine 210 of PRSS3 protein

A redox-regulated disulphide may form within PRSS3 protein between cysteines 34 and 164 (22 and 157 respectively in this structure).

Details

Redox score ?
83
PDB code
4dg4
Structure name
human mesotrypsin-s39y complexed with bovine pancreatic trypsin inhibitor (bpti)
Structure deposition date
2012-01-24
Thiol separation (Å)
2
Half-sphere exposure sum ?
67
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8N2U3
Residue number A
34
Residue number B
164
Peptide name
PRSS3 protein

Ligandability

Cysteine 34 of PRSS3 protein

Cysteine 164 of PRSS3 protein

A redox-regulated disulphide may form within PRSS3 protein between cysteines 175 and 189 (168 and 182 respectively in this structure).

Details

Redox score ?
81
PDB code
4dg4
Structure name
human mesotrypsin-s39y complexed with bovine pancreatic trypsin inhibitor (bpti)
Structure deposition date
2012-01-24
Thiol separation (Å)
2
Half-sphere exposure sum ?
80
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8N2U3
Residue number A
175
Residue number B
189
Peptide name
PRSS3 protein

Ligandability

Cysteine 175 of PRSS3 protein

Cysteine 189 of PRSS3 protein

A redox-regulated disulphide may form within PRSS3 protein between cysteines 52 and 68 (42 and 58 respectively in this structure).

Details

Redox score ?
78
PDB code
3l3t
Structure name
human mesotrypsin complexed with amyloid precursor protein inhibitor variant (appir15k)
Structure deposition date
2009-12-17
Thiol separation (Å)
2
Half-sphere exposure sum ?
101
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8N2U3
Residue number A
52
Residue number B
68
Peptide name
PRSS3 protein

Ligandability

Cysteine 52 of PRSS3 protein

Cysteine 68 of PRSS3 protein

A redox-regulated disulphide may form within PRSS3 protein between cysteines 200 and 224 (191 and 220 respectively in this structure).

Details

Redox score ?
75
PDB code
4dg4
Structure name
human mesotrypsin-s39y complexed with bovine pancreatic trypsin inhibitor (bpti)
Structure deposition date
2012-01-24
Thiol separation (Å)
2
Half-sphere exposure sum ?
103
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8N2U3
Residue number A
200
Residue number B
224
Peptide name
PRSS3 protein

Ligandability

Cysteine 200 of PRSS3 protein

Cysteine 224 of PRSS3 protein

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