Project name: SH3_G106Q

Status: done

submitted: 2019-03-14 19:06:11, status changed: 2019-03-14 20:41:49
Settings
Chain sequence(s) A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues GA106Q
Energy difference between WT (input) and mutated protein (by FoldX) 2.90426 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
1.7237
Average score
-0.9686
Total score value
-55.2079

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 0.5171
86 L A 0.7955
87 F A 0.8380
88 V A 0.3118
89 A A 0.0000
90 L A -0.1464
91 Y A -0.4752
92 D A -2.4569
93 Y A -1.8363
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 -2.6519
105 K A -2.2149
106 Q A -1.9176 mutated: GA106Q
107 E A -1.4848
108 K A -0.7448
109 F A 0.0000
110 Q A -0.5064
111 I A -0.0560
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 -1.7128
124 S A 0.0000
125 L A 0.0676
126 T A -0.5438
127 T A -0.8180
128 G A -1.3554
129 E A -2.2392
130 T A -1.6920
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 -0.0512
138 V A 0.0000
139 A A 0.3430
140 P A 0.7761
141 V A 1.7237

 

Laboratory of Theory of Biopolymers 2015