Project name: SH3_G131H

Status: done

submitted: 2019-03-14 19:21:34, status changed: 2019-03-14 22:36:40
Settings
Chain sequence(s) A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues GA131H
Energy difference between WT (input) and mutated protein (by FoldX) 6.86521 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
-3.1673
Maximal score value
1.7964
Average score
-0.9844
Total score value
-56.1107

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
85 T A 0.5173
86 L A 0.7932
87 F A 0.9238
88 V A 0.4313
89 A A 0.0000
90 L A -0.1511
91 Y A -0.5748
92 D A -2.5611
93 Y A -1.9337
94 E A -2.6480
95 A A -2.6703
96 R A -2.9863
97 T A -2.6617
98 E A -3.1673
99 D A -3.1533
100 D A 0.0000
101 L A 0.0000
102 S A -2.2611
103 F A 0.0000
104 H A -2.7295
105 K A -2.4059
106 G A -1.4581
107 E A -1.3078
108 K A -0.6426
109 F A 0.0000
110 Q A -0.5066
111 I A -0.0915
112 L A 0.1039
113 N A -0.8879
114 S A -1.1794
115 S A -1.5962
116 E A -2.5599
117 G A -2.1340
118 D A -2.4444
119 W A -1.1468
120 W A -1.1177
121 E A -1.2705
122 A A 0.0000
123 R A -1.7842
124 S A 0.0000
125 L A 0.0645
126 T A -0.4700
127 T A -0.8117
128 G A -1.3804
129 E A -2.2959
130 T A -1.8436
131 H A -1.8561 mutated: GA131H
132 Y A -1.0479
133 I A 0.0000
134 P A 0.0000
135 S A -0.9206
136 N A -1.1504
137 Y A -0.1243
138 V A 0.0000
139 A A 0.4158
140 P A 0.7757
141 V A 1.7964

 

Laboratory of Theory of Biopolymers 2015