Project name: SH3_G106S

Status: done

submitted: 2019-03-14 19:06:16, status changed: 2019-03-14 20:42:48
Settings
Chain sequence(s) A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues GA106S
Energy difference between WT (input) and mutated protein (by FoldX) 3.49726 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
-3.1028
Maximal score value
1.8196
Average score
-0.9355
Total score value
-53.3208

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 0.5165
86 L A 0.7914
87 F A 0.9505
88 V A 0.5227
89 A A 0.0000
90 L A -0.0509
91 Y A -0.4779
92 D A -2.4775
93 Y A -1.9122
94 E A -2.6452
95 A A -2.6259
96 R A -2.9852
97 T A -2.6608
98 E A -3.1028
99 D A -3.0434
100 D A 0.0000
101 L A 0.0000
102 S A -2.2059
103 F A 0.0000
104 H A -2.6068
105 K A -2.1711
106 S A -1.1518 mutated: GA106S
107 E A -1.1519
108 K A -0.5649
109 F A 0.0000
110 Q A -0.5101
111 I A -0.0568
112 L A 0.1429
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 -1.1028
120 W A -1.0557
121 E A -1.1530
122 A A 0.0000
123 R A -1.7155
124 S A 0.0000
125 L A 0.0585
126 T A -0.4465
127 T A -0.8205
128 G A -1.3572
129 E A -2.2401
130 T A -1.6927
131 G A -1.4992
132 Y A -0.8673
133 I A 0.0000
134 P A 0.0000
135 S A -0.9206
136 N A -1.1504
137 Y A -0.1107
138 V A 0.0000
139 A A 0.4386
140 P A 0.7736
141 V A 1.8196

 

Laboratory of Theory of Biopolymers 2015