ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

Neuroblastoma suppressor of tumorigenicity 1

Intermolecular
Cysteine 123 and cysteine 82
Cysteine 123 and cysteine 123
Cysteine 82 and cysteine 82
Cysteine 82 and cysteine 63
Cysteine 63 and cysteine 63
Intramolecular
Cysteine 49 and cysteine 99
Cysteine 59 and cysteine 118
Cysteine 35 and cysteine 85
Cysteine 63 and cysteine 120
Cysteine 35 and cysteine 118
More...
Cysteine 35 and cysteine 120
Cysteine 35 and cysteine 63
Cysteine 35 and cysteine 59
Cysteine 85 and cysteine 118
Cysteine 59 and cysteine 85
Cysteine 63 and cysteine 85
Cysteine 85 and cysteine 120
Cysteine 63 and cysteine 123
Cysteine 120 and cysteine 123
Cysteine 118 and cysteine 120
Cysteine 63 and cysteine 118
Cysteine 82 and cysteine 120
Cysteine 59 and cysteine 63
Cysteine 59 and cysteine 120
A redox-regulated disulphide may form between two units of Neuroblastoma suppressor of tumorigenicity 1 at cysteines 123 and 82.

Details

Redox score ?
77
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
4
Half-sphere exposure sum ?
68
Minimum pKa ?
nan
% buried
nan
Peptide A name
Neuroblastoma suppressor of tumorigenicity 1
Peptide B name
Neuroblastoma suppressor of tumorigenicity 1
Peptide A accession
P41271
Peptide B accession
P41271
Peptide A residue number
123
Peptide B residue number
82

Ligandability

Cysteine 123 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 82 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form between two units of Neuroblastoma suppressor of tumorigenicity 1 at cysteines 123 and 123.

Details

Redox score ?
76
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
4
Half-sphere exposure sum ?
62
Minimum pKa ?
nan
% buried
nan
Peptide A name
Neuroblastoma suppressor of tumorigenicity 1
Peptide B name
Neuroblastoma suppressor of tumorigenicity 1
Peptide A accession
P41271
Peptide B accession
P41271
Peptide A residue number
123
Peptide B residue number
123

Ligandability

A redox-regulated disulphide may form between two units of Neuroblastoma suppressor of tumorigenicity 1 at cysteines 82 and 82.

Details

Redox score ?
70
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
4
Half-sphere exposure sum ?
75
Minimum pKa ?
nan
% buried
nan
Peptide A name
Neuroblastoma suppressor of tumorigenicity 1
Peptide B name
Neuroblastoma suppressor of tumorigenicity 1
Peptide A accession
P41271
Peptide B accession
P41271
Peptide A residue number
82
Peptide B residue number
82

Ligandability

A redox-regulated disulphide may form between two units of Neuroblastoma suppressor of tumorigenicity 1 at cysteines 82 and 63. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
47
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
8
Half-sphere exposure sum ?
77
Minimum pKa ?
nan
% buried
nan
Peptide A name
Neuroblastoma suppressor of tumorigenicity 1
Peptide B name
Neuroblastoma suppressor of tumorigenicity 1
Peptide A accession
P41271
Peptide B accession
P41271
Peptide A residue number
82
Peptide B residue number
63

Ligandability

Cysteine 82 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 63 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form between two units of Neuroblastoma suppressor of tumorigenicity 1 at cysteines 63 and 63. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
35
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
10
Half-sphere exposure sum ?
80
Minimum pKa ?
nan
% buried
nan
Peptide A name
Neuroblastoma suppressor of tumorigenicity 1
Peptide B name
Neuroblastoma suppressor of tumorigenicity 1
Peptide A accession
P41271
Peptide B accession
P41271
Peptide A residue number
63
Peptide B residue number
63

Ligandability

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 49 and 99.

Details

Redox score ?
88
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
2
Half-sphere exposure sum ?
32
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
49
Residue number B
99
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 49 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 99 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 59 and 118.

Details

Redox score ?
85
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
2
Half-sphere exposure sum ?
74
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
59
Residue number B
118
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 59 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 118 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 35 and 85.

Details

Redox score ?
85
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
2
Half-sphere exposure sum ?
71
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
35
Residue number B
85
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 35 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 85 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 63 and 120.

Details

Redox score ?
82
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
2
Half-sphere exposure sum ?
77
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
63
Residue number B
120
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 63 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 120 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 35 and 118.

Details

Redox score ?
71
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
5
Half-sphere exposure sum ?
62
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
35
Residue number B
118
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 35 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 118 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 35 and 120.

Details

Redox score ?
71
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
5
Half-sphere exposure sum ?
67
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
35
Residue number B
120
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 35 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 120 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 35 and 63.

Details

Redox score ?
67
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
5
Half-sphere exposure sum ?
70
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
35
Residue number B
63
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 35 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 63 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 35 and 59.

Details

Redox score ?
67
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
5
Half-sphere exposure sum ?
69
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
35
Residue number B
59
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 35 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 59 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 85 and 118.

Details

Redox score ?
66
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
5
Half-sphere exposure sum ?
73
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
85
Residue number B
118
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 85 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 118 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 59 and 85.

Details

Redox score ?
63
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
5
Half-sphere exposure sum ?
82
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
59
Residue number B
85
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 59 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 85 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 63 and 85.

Details

Redox score ?
61
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
5
Half-sphere exposure sum ?
81
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
63
Residue number B
85
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 63 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 85 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 85 and 120.

Details

Redox score ?
61
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
6
Half-sphere exposure sum ?
77
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
85
Residue number B
120
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 85 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 120 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 63 and 123. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
55
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
7
Half-sphere exposure sum ?
70
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
63
Residue number B
123
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 63 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 123 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 120 and 123. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
46
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
9
Half-sphere exposure sum ?
69
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
120
Residue number B
123
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 120 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 123 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 118 and 120. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
40
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
10
Half-sphere exposure sum ?
72
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
118
Residue number B
120
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 118 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 120 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 63 and 118. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
39
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
10
Half-sphere exposure sum ?
72
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
63
Residue number B
118
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 63 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 118 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 82 and 120. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
38
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
10
Half-sphere exposure sum ?
73
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
82
Residue number B
120
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 82 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 120 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 59 and 63. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
37
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
10
Half-sphere exposure sum ?
80
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
59
Residue number B
63
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 59 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 63 of Neuroblastoma suppressor of tumorigenicity 1

A redox-regulated disulphide may form within Neuroblastoma suppressor of tumorigenicity 1 between cysteines 59 and 120. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
37
PDB code
4x1j
Structure name
x-ray crystal structure of the dimeric bmp antagonist nbl1
Structure deposition date
2014-11-24
Thiol separation (Å)
10
Half-sphere exposure sum ?
76
Minimum pKa ?
nan
% buried
nan
Peptide accession
P41271
Residue number A
59
Residue number B
120
Peptide name
Neuroblastoma suppressor of tumorigenicity 1

Ligandability

Cysteine 59 of Neuroblastoma suppressor of tumorigenicity 1

Cysteine 120 of Neuroblastoma suppressor of tumorigenicity 1

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