Project name: SH3_P140S

Status: done

submitted: 2019-03-14 19:26:18, status changed: 2019-03-14 23:12:23
Settings
Chain sequence(s) A: TLFVALYDYEARTEDDLSFHKGEEKFQQILNSSEGDWWEARRSLTTGETGYIPSNYVAPV
Distance of aggregation 10 Å
Dynamic mode No
Mutated residues PA140S
Energy difference between WT (input) and mutated protein (by FoldX) 1.91809 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
1.8396
Average score
-0.953
Total score value
-54.3214

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 0.5413
86 L A 0.8271
87 F A 0.9828
88 V A 0.4642
89 A A 0.0000
90 L A -0.1463
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 -1.4541
107 E A -1.3036
108 K A -0.6249
109 F A 0.0000
110 Q A -0.4946
111 I A -0.0494
112 L A 0.1439
113 N A -0.8873
114 S A -1.1789
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 -1.0552
121 E A -1.1525
122 A A 0.0000
123 R A -1.7150
124 S A 0.0000
125 L A 0.0621
126 T A -0.4730
127 T A -0.8207
128 G A -1.3572
129 E A -2.2401
130 T A -1.6925
131 G A -1.4990
132 Y A -0.8671
133 I A 0.0000
134 P A 0.0000
135 S A -0.9158
136 N A -1.1492
137 Y A -0.1197
138 V A 0.0000
139 A A 0.4642
140 S A 0.8563 mutated: PA140S
141 V A 1.8396

 

Laboratory of Theory of Biopolymers 2015