ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

Integrin alpha-5

Intramolecular
Cysteine 869 and cysteine 921
Cysteine 645 and cysteine 651
Cysteine 911 and cysteine 916
Cysteine 528 and cysteine 584
Cysteine 99 and cysteine 108
Cysteine 513 and cysteine 522
Cysteine 718 and cysteine 731
Cysteine 849 and cysteine 957
Cysteine 192 and cysteine 205 L
Cysteine 156 and cysteine 176
More...
Cysteine 849 and cysteine 916
Cysteine 916 and cysteine 957
Cysteine 849 and cysteine 911
Cysteine 911 and cysteine 957
Cysteine 176 and cysteine 205 L
Cysteine 176 and cysteine 192
Cysteine 156 and cysteine 192
A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 869 and 921 (828 and 880 respectively in this structure).

Details

Redox score ?
88
PDB code
7nxd
Structure name
cryo-em structure of human integrin alpha5beta1 in the half-bent conformation
Structure deposition date
2021-03-18
Thiol separation (Å)
2
Half-sphere exposure sum ?
57
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
869
Residue number B
921
Peptide name
Integrin alpha-5

Ligandability

Cysteine 869 of Integrin alpha-5

Cysteine 921 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 645 and 651 (604 and 610 respectively in this structure).

Details

Redox score ?
86
PDB code
7nxd
Structure name
cryo-em structure of human integrin alpha5beta1 in the half-bent conformation
Structure deposition date
2021-03-18
Thiol separation (Å)
2
Half-sphere exposure sum ?
63
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
645
Residue number B
651
Peptide name
Integrin alpha-5

Ligandability

Cysteine 645 of Integrin alpha-5

Cysteine 651 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 911 and 916 (870 and 875 respectively in this structure).

Details

Redox score ?
85
PDB code
7nxd
Structure name
cryo-em structure of human integrin alpha5beta1 in the half-bent conformation
Structure deposition date
2021-03-18
Thiol separation (Å)
2
Half-sphere exposure sum ?
55
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
911
Residue number B
916
Peptide name
Integrin alpha-5

Ligandability

Cysteine 911 of Integrin alpha-5

Cysteine 916 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 528 and 584 (487 and 543 respectively in this structure).

Details

Redox score ?
85
PDB code
3vi4
Structure name
crystal structure of alpha5beta1 integrin headpiece in complex with rgd peptide
Structure deposition date
2011-09-21
Thiol separation (Å)
2
Half-sphere exposure sum ?
45
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
528
Residue number B
584
Peptide name
Integrin alpha-5

Ligandability

Cysteine 528 of Integrin alpha-5

Cysteine 584 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 99 and 108 (58 and 67 respectively in this structure).

Details

Redox score ?
85
PDB code
4wk4
Structure name
metal ion and ligand binding of integrin
Structure deposition date
2014-10-01
Thiol separation (Å)
2
Half-sphere exposure sum ?
67
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
99
Residue number B
108
Peptide name
Integrin alpha-5

Ligandability

Cysteine 99 of Integrin alpha-5

Cysteine 108 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 513 and 522 (472 and 481 respectively in this structure).

Details

Redox score ?
82
PDB code
3vi4
Structure name
crystal structure of alpha5beta1 integrin headpiece in complex with rgd peptide
Structure deposition date
2011-09-21
Thiol separation (Å)
2
Half-sphere exposure sum ?
53
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
513
Residue number B
522
Peptide name
Integrin alpha-5

Ligandability

Cysteine 513 of Integrin alpha-5

Cysteine 522 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 718 and 731 (677 and 690 respectively in this structure).

Details

Redox score ?
82
PDB code
7nxd
Structure name
cryo-em structure of human integrin alpha5beta1 in the half-bent conformation
Structure deposition date
2021-03-18
Thiol separation (Å)
2
Half-sphere exposure sum ?
71
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
718
Residue number B
731
Peptide name
Integrin alpha-5

Ligandability

Cysteine 718 of Integrin alpha-5

Cysteine 731 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 849 and 957 (808 and 916 respectively in this structure).

Details

Redox score ?
80
PDB code
7nxd
Structure name
cryo-em structure of human integrin alpha5beta1 in the half-bent conformation
Structure deposition date
2021-03-18
Thiol separation (Å)
2
Half-sphere exposure sum ?
82
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
849
Residue number B
957
Peptide name
Integrin alpha-5

Ligandability

Cysteine 849 of Integrin alpha-5

Cysteine 957 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 192 and 205 (151 and 164 respectively in this structure).

Details

Redox score ?
79
PDB code
4wk4
Structure name
metal ion and ligand binding of integrin
Structure deposition date
2014-10-01
Thiol separation (Å)
2
Half-sphere exposure sum ?
100
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
192
Residue number B
205
Peptide name
Integrin alpha-5

Ligandability

Cysteine 192 of Integrin alpha-5

Cysteine 205 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 156 and 176 (115 and 135 respectively in this structure).

Details

Redox score ?
78
PDB code
4wk2
Structure name
metal ion and ligand binding of integrin
Structure deposition date
2014-10-01
Thiol separation (Å)
2
Half-sphere exposure sum ?
97
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
156
Residue number B
176
Peptide name
Integrin alpha-5

Ligandability

Cysteine 156 of Integrin alpha-5

Cysteine 176 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 849 and 916 (808 and 875 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
50
PDB code
7nxd
Structure name
cryo-em structure of human integrin alpha5beta1 in the half-bent conformation
Structure deposition date
2021-03-18
Thiol separation (Å)
8
Half-sphere exposure sum ?
71
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
849
Residue number B
916
Peptide name
Integrin alpha-5

Ligandability

Cysteine 849 of Integrin alpha-5

Cysteine 916 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 916 and 957 (875 and 916 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
47
PDB code
7nxd
Structure name
cryo-em structure of human integrin alpha5beta1 in the half-bent conformation
Structure deposition date
2021-03-18
Thiol separation (Å)
8
Half-sphere exposure sum ?
69
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
916
Residue number B
957
Peptide name
Integrin alpha-5

Ligandability

Cysteine 916 of Integrin alpha-5

Cysteine 957 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 849 and 911 (808 and 870 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
7nxd
Structure name
cryo-em structure of human integrin alpha5beta1 in the half-bent conformation
Structure deposition date
2021-03-18
Thiol separation (Å)
9
Half-sphere exposure sum ?
68
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
849
Residue number B
911
Peptide name
Integrin alpha-5

Ligandability

Cysteine 849 of Integrin alpha-5

Cysteine 911 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 911 and 957 (870 and 916 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
7nxd
Structure name
cryo-em structure of human integrin alpha5beta1 in the half-bent conformation
Structure deposition date
2021-03-18
Thiol separation (Å)
9
Half-sphere exposure sum ?
65
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
911
Residue number B
957
Peptide name
Integrin alpha-5

Ligandability

Cysteine 911 of Integrin alpha-5

Cysteine 957 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 176 and 205 (135 and 164 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
3vi4
Structure name
crystal structure of alpha5beta1 integrin headpiece in complex with rgd peptide
Structure deposition date
2011-09-21
Thiol separation (Å)
9
Half-sphere exposure sum ?
98
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
176
Residue number B
205
Peptide name
Integrin alpha-5

Ligandability

Cysteine 176 of Integrin alpha-5

Cysteine 205 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 176 and 192 (135 and 151 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
3vi3
Structure name
crystal structure of alpha5beta1 integrin headpiece (ligand-free form)
Structure deposition date
2011-09-21
Thiol separation (Å)
10
Half-sphere exposure sum ?
97
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
176
Residue number B
192
Peptide name
Integrin alpha-5

Ligandability

Cysteine 176 of Integrin alpha-5

Cysteine 192 of Integrin alpha-5

A redox-regulated disulphide may form within Integrin alpha-5 between cysteines 156 and 192 (115 and 151 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
7nxd
Structure name
cryo-em structure of human integrin alpha5beta1 in the half-bent conformation
Structure deposition date
2021-03-18
Thiol separation (Å)
10
Half-sphere exposure sum ?
97
Minimum pKa ?
nan
% buried
nan
Peptide accession
P08648
Residue number A
156
Residue number B
192
Peptide name
Integrin alpha-5

Ligandability

Cysteine 156 of Integrin alpha-5

Cysteine 192 of Integrin alpha-5

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