Project name: SH3_S115V

Status: done

submitted: 2019-03-14 19:11:54, status changed: 2019-03-14 21:24:34
Settings
Chain sequence(s) A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues SA115V
Energy difference between WT (input) and mutated protein (by FoldX) 1.18998 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
-3.1024
Maximal score value
1.7964
Average score
-0.8417
Total score value
-47.9775

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 -2.5599
93 Y A -1.9315
94 E A -2.6452
95 A A -2.6254
96 R A -2.9852
97 T A -2.6608
98 E A -3.1024
99 D A -3.0425
100 D A 0.0000
101 L A 0.0000
102 S A -2.2055
103 F A 0.0000
104 H A -2.7282
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 -0.5117
111 I A -0.0533
112 L A 0.3778
113 N A -0.2803
114 S A -0.1713
115 V A 0.4075 mutated: SA115V
116 E A -1.5748
117 G A -1.4859
118 D A -2.0926
119 W A -0.8336
120 W A -0.6814
121 E A -0.9159
122 A A 0.0000
123 R A -1.7174
124 S A 0.0000
125 L A 0.0592
126 T A -0.4730
127 T A -0.8207
128 G A -1.3572
129 E A -2.2401
130 T A -1.6935
131 G A -1.4985
132 Y A -0.8601
133 I A 0.0000
134 P A 0.0000
135 S A -0.9132
136 N A -1.1500
137 Y A -0.1241
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