Metalloproteinase inhibitor 1
Intramolecular
Cysteine 150 and cysteine 197
Cysteine 150 and cysteine 93
Cysteine 24 and cysteine 93
Cysteine 155 and cysteine 160
Cysteine 168 and cysteine 189
Cysteine 36 and cysteine 147
Cysteine 26 and cysteine 122
Cysteine 24 and cysteine 26
Cysteine 24 and cysteine 122
Cysteine 150 and cysteine 26
More...Cysteine 150 and cysteine 189
Cysteine 189 and cysteine 197
Cysteine 93 and cysteine 122
Cysteine 150 and cysteine 168
Cysteine 168 and cysteine 197
Cysteine 26 and cysteine 93
Cysteine 150 and cysteine 122
Cysteine 147 and cysteine 150
Cysteine 36 and cysteine 150
Cysteine 36 and cysteine 189
1uea B 127 B 174
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 150 and 197 (127 and 174 respectively in this structure).
Details
Redox score ?
87
PDB code
1uea
Structure name
mmp-3/timp-1 complex
Structure deposition date
1997-06-06
Thiol separation (Å)
2
Half-sphere exposure sum ?
62
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
150
Residue number B
197
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 150 of Metalloproteinase inhibitor 1
Cysteine 197 of Metalloproteinase inhibitor 1
1oo9 B 301 B 370
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 150 and 93 (301 and 370 respectively in this structure).
Details
Redox score ?
86
PDB code
1oo9
Structure name
orientation in solution of mmp-3 catalytic domain and n-timp-1 from residual dipolar couplings
Structure deposition date
2003-03-03
Thiol separation (Å)
2
Half-sphere exposure sum ?
nan
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
150
Residue number B
93
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 150 of Metalloproteinase inhibitor 1
Cysteine 93 of Metalloproteinase inhibitor 1
3ma2 B 301 B 370
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 24 and 93 (301 and 370 respectively in this structure).
Details
Redox score ?
86
PDB code
3ma2
Structure name
complex membrane type-1 matrix metalloproteinase (mt1-mmp) with tissue inhibitor of metalloproteinase-1 (timp-1)
Structure deposition date
2010-03-23
Thiol separation (Å)
2
Half-sphere exposure sum ?
nan
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
24
Residue number B
93
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 24 of Metalloproteinase inhibitor 1
Cysteine 93 of Metalloproteinase inhibitor 1
1uea D 132 D 137
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 155 and 160 (132 and 137 respectively in this structure).
Details
Redox score ?
86
PDB code
1uea
Structure name
mmp-3/timp-1 complex
Structure deposition date
1997-06-06
Thiol separation (Å)
2
Half-sphere exposure sum ?
54
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
155
Residue number B
160
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 155 of Metalloproteinase inhibitor 1
Cysteine 160 of Metalloproteinase inhibitor 1
1uea B 145 B 166
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 168 and 189 (145 and 166 respectively in this structure).
Details
Redox score ?
82
PDB code
1uea
Structure name
mmp-3/timp-1 complex
Structure deposition date
1997-06-06
Thiol separation (Å)
2
Half-sphere exposure sum ?
77
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
168
Residue number B
189
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 168 of Metalloproteinase inhibitor 1
Cysteine 189 of Metalloproteinase inhibitor 1
1uea B 13 B 124
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 36 and 147 (13 and 124 respectively in this structure).
Details
Redox score ?
82
PDB code
1uea
Structure name
mmp-3/timp-1 complex
Structure deposition date
1997-06-06
Thiol separation (Å)
2
Half-sphere exposure sum ?
62
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
36
Residue number B
147
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 36 of Metalloproteinase inhibitor 1
Cysteine 147 of Metalloproteinase inhibitor 1
2j0t E 3 E 99
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 26 and 122 (3 and 99 respectively in this structure).
Details
Redox score ?
80
PDB code
2j0t
Structure name
crystal structure of the catalytic domain of mmp-1 in complex with the inhibitory domain of timp-1
Structure deposition date
2006-08-04
Thiol separation (Å)
2
Half-sphere exposure sum ?
82
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
26
Residue number B
122
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 26 of Metalloproteinase inhibitor 1
Cysteine 122 of Metalloproteinase inhibitor 1
2j0t F 1 F 3
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 24 and 26 (1 and 3 respectively in this structure).
Details
Redox score ?
78
PDB code
2j0t
Structure name
crystal structure of the catalytic domain of mmp-1 in complex with the inhibitory domain of timp-1
Structure deposition date
2006-08-04
Thiol separation (Å)
4
Half-sphere exposure sum ?
nan
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
24
Residue number B
26
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 24 of Metalloproteinase inhibitor 1
Cysteine 26 of Metalloproteinase inhibitor 1
3ma2 B 301 B 399
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 24 and 122 (301 and 399 respectively in this structure).
Details
Redox score ?
76
PDB code
3ma2
Structure name
complex membrane type-1 matrix metalloproteinase (mt1-mmp) with tissue inhibitor of metalloproteinase-1 (timp-1)
Structure deposition date
2010-03-23
Thiol separation (Å)
4
Half-sphere exposure sum ?
nan
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
24
Residue number B
122
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 24 of Metalloproteinase inhibitor 1
Cysteine 122 of Metalloproteinase inhibitor 1
1oo9 B 301 B 303
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 150 and 26 (301 and 303 respectively in this structure).
Details
Redox score ?
73
PDB code
1oo9
Structure name
orientation in solution of mmp-3 catalytic domain and n-timp-1 from residual dipolar couplings
Structure deposition date
2003-03-03
Thiol separation (Å)
4
Half-sphere exposure sum ?
nan
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
150
Residue number B
26
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 150 of Metalloproteinase inhibitor 1
Cysteine 26 of Metalloproteinase inhibitor 1
1uea D 127 D 166
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 150 and 189 (127 and 166 respectively in this structure).
Details
Redox score ?
71
PDB code
1uea
Structure name
mmp-3/timp-1 complex
Structure deposition date
1997-06-06
Thiol separation (Å)
4
Half-sphere exposure sum ?
72
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
150
Residue number B
189
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 150 of Metalloproteinase inhibitor 1
Cysteine 189 of Metalloproteinase inhibitor 1
3v96 A 166 A 174
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 189 and 197 (166 and 174 respectively in this structure).
Details
Redox score ?
66
PDB code
3v96
Structure name
complex of matrix metalloproteinase-10 catalytic domain (mmp-10cd) with tissue inhibitor of metalloproteinases-1 (timp-1)
Structure deposition date
2011-12-23
Thiol separation (Å)
5
Half-sphere exposure sum ?
66
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
189
Residue number B
197
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 189 of Metalloproteinase inhibitor 1
Cysteine 197 of Metalloproteinase inhibitor 1
2j0t E 70 E 99
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 93 and 122 (70 and 99 respectively in this structure).
Details
Redox score ?
65
PDB code
2j0t
Structure name
crystal structure of the catalytic domain of mmp-1 in complex with the inhibitory domain of timp-1
Structure deposition date
2006-08-04
Thiol separation (Å)
4
Half-sphere exposure sum ?
86
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
93
Residue number B
122
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 93 of Metalloproteinase inhibitor 1
Cysteine 122 of Metalloproteinase inhibitor 1
7s7m B 127 B 145
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 150 and 168 (127 and 145 respectively in this structure).
Details
Redox score ?
63
PDB code
7s7m
Structure name
complex of tissue inhibitor of metalloproteinases-1 (timp-1) mutant (l34g/m66d/t98g/p131s/q153n) with matrix metalloproteinase-3 catalytic domain (mmp-3cd)
Structure deposition date
2021-09-16
Thiol separation (Å)
6
Half-sphere exposure sum ?
68
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
150
Residue number B
168
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 150 of Metalloproteinase inhibitor 1
Cysteine 168 of Metalloproteinase inhibitor 1
3v96 A 145 A 174
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 168 and 197 (145 and 174 respectively in this structure).
Details
Redox score ?
62
PDB code
3v96
Structure name
complex of matrix metalloproteinase-10 catalytic domain (mmp-10cd) with tissue inhibitor of metalloproteinases-1 (timp-1)
Structure deposition date
2011-12-23
Thiol separation (Å)
6
Half-sphere exposure sum ?
64
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
168
Residue number B
197
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 168 of Metalloproteinase inhibitor 1
Cysteine 197 of Metalloproteinase inhibitor 1
6n9d B 3 B 70
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 26 and 93 (3 and 70 respectively in this structure).
Details
Redox score ?
61
PDB code
6n9d
Structure name
complex of tissue inhibitor of metalloproteinases-1 (timp-1) mutant (l34g/l133p/l151c/g154a) with matrix metalloproteinase-3 catalytic domain (mmp-3cd)
Structure deposition date
2018-12-03
Thiol separation (Å)
5
Half-sphere exposure sum ?
87
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
26
Residue number B
93
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 26 of Metalloproteinase inhibitor 1
Cysteine 93 of Metalloproteinase inhibitor 1
1d2b A 1 A 99
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 150 and 122 (1 and 99 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?
Details
Redox score ?
56
PDB code
1d2b
Structure name
the mmp-inhibitory, n-terminal domain of human tissue inhibitor of metalloproteinases-1 (n-timp-1), solution nmr, 29 structures
Structure deposition date
1999-09-22
Thiol separation (Å)
8
Half-sphere exposure sum ?
nan
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
150
Residue number B
122
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 150 of Metalloproteinase inhibitor 1
Cysteine 122 of Metalloproteinase inhibitor 1
1uea D 124 D 127
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 147 and 150 (124 and 127 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
1uea
Structure name
mmp-3/timp-1 complex
Structure deposition date
1997-06-06
Thiol separation (Å)
9
Half-sphere exposure sum ?
62
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
147
Residue number B
150
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 147 of Metalloproteinase inhibitor 1
Cysteine 150 of Metalloproteinase inhibitor 1
6n9d B 13 B 127
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 36 and 150 (13 and 127 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
6n9d
Structure name
complex of tissue inhibitor of metalloproteinases-1 (timp-1) mutant (l34g/l133p/l151c/g154a) with matrix metalloproteinase-3 catalytic domain (mmp-3cd)
Structure deposition date
2018-12-03
Thiol separation (Å)
9
Half-sphere exposure sum ?
67
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
36
Residue number B
150
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 36 of Metalloproteinase inhibitor 1
Cysteine 150 of Metalloproteinase inhibitor 1
7s7l B 13 B 166
A redox-regulated disulphide may form within Metalloproteinase inhibitor 1 between cysteines 36 and 189 (13 and 166 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?
Details
Redox score ?
39
PDB code
7s7l
Structure name
complex of tissue inhibitor of metalloproteinases-1 (timp-1) mutant (l34g/m66s/e67y/l133n/s155l) with matrix metalloproteinase-3 catalytic domain (mmp-3cd)
Structure deposition date
2021-09-16
Thiol separation (Å)
9
Half-sphere exposure sum ?
75
Minimum pKa ?
nan
% buried
nan
Peptide accession
P01033
Residue number A
36
Residue number B
189
Peptide name
Metalloproteinase inhibitor 1
Ligandability
Cysteine 36 of Metalloproteinase inhibitor 1
Cysteine 189 of Metalloproteinase inhibitor 1
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