Project name: SH3_G117M

Status: done

submitted: 2019-03-14 19:13:04, status changed: 2019-03-14 21:35:35
Settings
Chain sequence(s) A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues GA117M
Energy difference between WT (input) and mutated protein (by FoldX) 3.72575 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
1.7964
Average score
-0.8711
Total score value
-49.6538

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 0.9236
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 -2.6259
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 -2.7282
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 -0.5086
111 I A -0.0560
112 L A 0.1439
113 N A -0.6744
114 S A -0.7909
115 S A -1.0993
116 E A -1.7670
117 M A -0.7092 mutated: GA117M
118 D A -1.7555
119 W A -0.6883
120 W A -0.7434
121 E A -0.9969
122 A A 0.0000
123 R A -1.7150
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 -1.6927
131 G A -1.4999
132 Y A -0.8698
133 I A 0.0000
134 P A 0.0000
135 S A -0.7439
136 N A -1.1527
137 Y A -0.1263
138 V A 0.0000
139 A A 0.4155
140 P A 0.7757
141 V A 1.7964

 

Laboratory of Theory of Biopolymers 2015