Project name: SH3_W120N

Status: done

submitted: 2019-03-14 19:15:20, status changed: 2019-03-14 21:52:33
Settings
Chain sequence(s) A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues WA120N
Energy difference between WT (input) and mutated protein (by FoldX) 3.15689 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
1.8431
Average score
-0.9477
Total score value
-54.0196

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 0.5552
86 L A 0.8664
87 F A 1.0613
88 V A 0.4984
89 A A 0.0000
90 L A -0.1344
91 Y A -0.5743
92 D A -2.5596
93 Y A -1.9312
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 -2.4057
106 G A -1.4418
107 E A -1.2872
108 K A -0.5967
109 F A 0.0000
110 Q A -0.4778
111 I A -0.0575
112 L A 0.1073
113 N A -0.9712
114 S A -1.3212
115 S A -1.6680
116 E A -2.6249
117 G A -2.2101
118 D A -2.5269
119 W A -1.2187
120 N A 0.0000 mutated: WA120N
121 E A -1.2520
122 A A 0.0000
123 R A -1.7261
124 S A 0.0000
125 L A 0.0733
126 T A -0.4730
127 T A -0.8207
128 G A -1.3572
129 E A -2.2401
130 T A -1.6891
131 G A -1.5247
132 Y A -0.9336
133 I A 0.0000
134 P A 0.0000
135 S A -0.9949
136 N A -1.1835
137 Y A -0.1173
138 V A 0.0000
139 A A 0.4575
140 P A 0.8347
141 V A 1.8431

 

Laboratory of Theory of Biopolymers 2015