Project name: SH3_T129H

Status: done

submitted: 2019-03-14 15:37:40, status changed: 2019-03-14 18:22:33
Settings
Chain sequence(s) A: GSHMTFVALYDYESRTETDLSFKKGERLQIVNNTEGDWWLAHSLTTGQTGYIPSNYVAPS
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues TA129H
Energy difference between WT (input) and mutated protein (by FoldX) 1.00998 kcal/mol

CAUTION: Your mutation/s can destabilize the protein structure

Changes in protein stability upon mutation are calculated using the FoldX forcefield. Computational prediction of protein stability is used with the intention of preventing the experimental characterization of proteins bearing mutations that significantly destabilize their structure. Mutations resulting in a predicted reduction in protein stability ≥ 1 kcal/mol are considered disruptive.

Show buried residues

Minimal score value
-3.4838
Maximal score value
0.676
Average score
-0.9712
Total score value
-58.2717

The table below lists A3D score for protein residues. Residues with A3D score > 0.0000 are marked by yellow rows.

residue index residue name chain Aggrescan3D score mutation
residue index residue name chain Aggrescan3D score
mutation
81 G A -0.5019
82 S A -0.6760
83 H A -0.7865
84 M A 0.2752
85 T A 0.0000
86 F A -0.0936
87 V A -0.6167
88 A A 0.0000
89 L A -0.3125
90 Y A -0.7367
91 D A -2.8528
92 Y A -2.1055
93 E A -2.8815
94 S A 0.0000
95 R A -2.7837
96 T A -2.1552
97 E A -2.3537
98 T A -1.3898
99 D A -1.4909
100 L A 0.0000
101 S A -2.0376
102 F A 0.0000
103 K A -3.4838
104 K A -2.8616
105 G A -1.9621
106 E A 0.0000
107 R A -2.0006
108 L A 0.0000
109 Q A -0.4184
110 I A 0.1198
111 V A 0.6760
112 N A -0.6314
113 N A -1.9122
114 T A -1.7807
115 E A -2.9337
116 G A -2.6065
117 D A -2.6855
118 W A -1.3443
119 W A -0.7982
120 L A 0.0537
121 A A 0.0000
122 H A -0.9037
123 S A 0.0000
124 L A -0.1775
125 T A -0.6821
126 T A -0.9626
127 G A -1.0026
128 Q A -1.8617
129 H A -1.4871 mutated: TA129H
130 G A 0.0000
131 Y A -0.0421
132 I A 0.0000
133 P A 0.0000
134 S A -1.2879
135 N A -1.2485
136 Y A -0.2039
137 V A 0.0000
138 A A -0.0212
139 P A -0.1460
140 S A -0.1759

 

Laboratory of Theory of Biopolymers 2015