## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
202 |
38 |
95749 |
◊ |
A |
x,-y,-z |
4_555 |
202 |
38 |
95749 |
1501.5 |
-33.7 |
0.988 |
10 |
0 |
0 |
0.074 |
2 |
|
B |
132 |
14 |
3785 |
◊ |
A |
x,y,z |
1_555 |
138 |
28 |
95749 |
1122.9 |
-21.1 |
0.926 |
16 |
0 |
0 |
0.106 |
3 |
|
A |
123 |
30 |
95749 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
121 |
30 |
95749 |
933.2 |
-27.1 |
0.898 |
4 |
0 |
0 |
0.057 |
4 |
|
A |
60 |
20 |
95749 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
62 |
21 |
95749 |
354.2 |
-14.3 |
0.790 |
0 |
0 |
0 |
0.029 |
5 |
|
[IRI]A:720 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
35 |
10 |
95749 |
213.0 |
-4.5 |
0.466 |
9 |
0 |
0 |
0.034 |
6 |
|
[IRI]A:704 |
6 |
1 |
295 |
cf |
A |
x,y,z |
1_555 |
28 |
8 |
95749 |
193.8 |
-2.8 |
0.360 |
10 |
0 |
0 |
0.029 |
7 |
|
A |
27 |
7 |
95749 |
x |
A |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
33 |
8 |
95749 |
190.8 |
-5.2 |
0.777 |
2 |
0 |
0 |
0.000 |
8 |
|
[IRI]A:717 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
26 |
7 |
95749 |
190.1 |
-2.9 |
0.469 |
7 |
0 |
0 |
0.024 |
9 |
|
[IRI]A:710 |
6 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
95749 |
189.3 |
-2.1 |
0.460 |
9 |
0 |
0 |
0.024 |
10 |
|
[IRI]A:706 |
6 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
33 |
10 |
95749 |
188.2 |
-0.7 |
0.516 |
6 |
0 |
0 |
0.013 |
11 |
|
[IRI]A:883 |
6 |
1 |
295 |
cf |
A |
x,y,z |
1_555 |
31 |
8 |
95749 |
188.0 |
0.2 |
0.530 |
2 |
0 |
0 |
0.003 |
12 |
|
[IRI]A:709 |
6 |
1 |
294 |
cf |
A |
x,y,z |
1_555 |
34 |
11 |
95749 |
178.3 |
-2.1 |
0.481 |
4 |
0 |
0 |
0.016 |
13 |
|
[IRI]A:733 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
29 |
9 |
95749 |
175.8 |
-3.2 |
0.353 |
4 |
0 |
0 |
0.020 |
14 |
|
[IRI]A:732 |
6 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
25 |
10 |
95749 |
172.6 |
-3.2 |
0.382 |
5 |
0 |
0 |
0.022 |
15 |
|
[IRI]A:729 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
25 |
8 |
95749 |
170.9 |
-2.9 |
0.249 |
4 |
0 |
0 |
0.019 |
16 |
|
[IRI]A:718 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
20 |
7 |
95749 |
165.3 |
-2.3 |
0.429 |
7 |
0 |
0 |
0.022 |
17 |
|
[IRI]A:715 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
95749 |
159.9 |
0.9 |
0.308 |
4 |
0 |
0 |
0.004 |
18 |
|
[IRI]A:735 |
6 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
28 |
10 |
95749 |
156.3 |
-1.2 |
0.294 |
5 |
0 |
0 |
0.014 |
19 |
|
[IRI]A:714 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
25 |
11 |
95749 |
153.4 |
-1.2 |
0.544 |
5 |
0 |
0 |
0.014 |
20 |
|
[IRI]A:712 |
6 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
23 |
9 |
95749 |
152.1 |
-1.5 |
0.378 |
4 |
0 |
0 |
0.013 |
21 |
|
[IRI]A:711 |
6 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
26 |
11 |
95749 |
151.9 |
-2.8 |
0.259 |
8 |
0 |
0 |
0.025 |
22 |
|
[IRI]A:884 |
6 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
21 |
10 |
95749 |
149.0 |
-0.8 |
0.285 |
4 |
0 |
0 |
0.011 |
23 |
|
[IRI]A:716 |
6 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
25 |
9 |
95749 |
148.9 |
-2.8 |
0.253 |
6 |
0 |
0 |
0.022 |
24 |
|
[IRI]A:736 |
6 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
21 |
7 |
95749 |
147.5 |
-2.0 |
0.259 |
8 |
0 |
0 |
0.023 |
25 |
|
[IRI]A:705 |
6 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
29 |
6 |
95749 |
146.7 |
-2.9 |
0.267 |
4 |
0 |
0 |
0.019 |
26 |
|
[IRI]A:723 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
24 |
9 |
95749 |
142.7 |
-3.3 |
0.209 |
4 |
0 |
0 |
0.020 |
27 |
|
[IRI]A:707 |
6 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
95749 |
138.7 |
-1.1 |
0.370 |
5 |
0 |
0 |
0.013 |
28 |
|
[IRI]A:728 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
22 |
8 |
95749 |
138.6 |
-0.9 |
0.286 |
5 |
0 |
0 |
0.013 |
29 |
|
[IRI]A:739 |
6 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
22 |
8 |
95749 |
136.8 |
-3.4 |
0.197 |
6 |
0 |
0 |
0.025 |
30 |
|
[IRI]A:719 |
6 |
1 |
296 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
95749 |
135.5 |
-1.7 |
0.319 |
8 |
0 |
0 |
0.021 |
31 |
|
[IRI]A:708 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
15 |
4 |
95749 |
131.8 |
-4.1 |
0.131 |
5 |
0 |
0 |
0.025 |
32 |
|
[IRI]A:734 |
6 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
95749 |
131.0 |
-1.1 |
0.454 |
5 |
0 |
0 |
0.013 |
33 |
|
[IRI]A:882 |
5 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
23 |
7 |
95749 |
129.4 |
-2.5 |
0.288 |
4 |
0 |
0 |
0.017 |
34 |
|
A |
21 |
3 |
95749 |
x |
A |
-x,-y,z-1/2 |
2_554 |
19 |
3 |
95749 |
129.0 |
-1.3 |
0.765 |
0 |
0 |
0 |
0.000 |
35 |
|
[IRI]A:703 |
6 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
95749 |
127.6 |
-0.4 |
0.243 |
4 |
0 |
0 |
0.009 |
36 |
|
[IRI]A:880 |
5 |
1 |
294 |
cf |
A |
x,y,z |
1_555 |
16 |
5 |
95749 |
124.3 |
-4.0 |
0.187 |
4 |
0 |
0 |
0.023 |
37 |
|
[IRI]A:727 |
6 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
25 |
9 |
95749 |
123.7 |
-2.1 |
0.234 |
4 |
0 |
0 |
0.016 |
38 |
|
[IRI]A:737 |
6 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
27 |
7 |
95749 |
123.3 |
-0.4 |
0.260 |
2 |
0 |
0 |
0.005 |
39 |
|
[IRI]A:722 |
5 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
95749 |
116.4 |
-2.7 |
0.291 |
4 |
0 |
0 |
0.018 |
40 |
|
[IRI]A:721 |
5 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
95749 |
115.8 |
-0.1 |
0.561 |
1 |
0 |
0 |
0.002 |
41 |
|
[IRI]A:725 |
5 |
1 |
293 |
f |
A |
-x,y,-z-1/2 |
3_554 |
16 |
5 |
95749 |
115.1 |
-2.9 |
0.263 |
4 |
0 |
0 |
0.019 |
42 |
|
A |
17 |
7 |
95749 |
f |
[IRI]A:740 |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
5 |
1 |
295 |
113.6 |
-2.4 |
0.363 |
5 |
0 |
0 |
0.018 |
43 |
|
[IRI]A:724 |
6 |
1 |
293 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
16 |
4 |
95749 |
107.7 |
-1.5 |
0.324 |
4 |
0 |
0 |
0.013 |
44 |
|
[IRI]A:738 |
5 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
95749 |
106.0 |
-2.6 |
0.119 |
5 |
0 |
0 |
0.020 |
45 |
|
[IRI]A:731 |
4 |
1 |
296 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
95749 |
86.5 |
-2.0 |
0.298 |
2 |
0 |
0 |
0.012 |
46 |
|
[IRI]A:726 |
5 |
1 |
296 |
f |
A |
x,y,z |
1_555 |
15 |
2 |
95749 |
86.3 |
0.8 |
0.509 |
2 |
0 |
0 |
0.000 |
47 |
|
[NA]A:822 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
95749 |
76.5 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.049 |
48 |
|
[IRI]A:881 |
5 |
1 |
294 |
◊ |
A |
x,-y,-z |
4_555 |
7 |
3 |
95749 |
73.7 |
-1.2 |
0.297 |
3 |
0 |
0 |
0.010 |
49 |
|
[NA]A:831 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
95749 |
68.7 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.041 |
50 |
|
[NA]A:832 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
95749 |
63.8 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.042 |
51 |
|
[NA]A:827 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
95749 |
63.4 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.050 |
52 |
|
[IRI]A:731 |
4 |
1 |
296 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
12 |
2 |
95749 |
62.3 |
-1.2 |
0.807 |
3 |
0 |
0 |
0.010 |
53 |
|
[IRI]A:724 |
5 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
95749 |
56.1 |
-2.2 |
0.100 |
2 |
0 |
0 |
0.012 |
54 |
|
[NA]A:828 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
95749 |
51.6 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.027 |
55 |
|
[IRI]A:737 |
4 |
1 |
294 |
f |
[IRI]A:736 |
x,y,z |
1_555 |
4 |
1 |
294 |
50.5 |
1.0 |
0.120 |
0 |
0 |
0 |
0.000 |
56 |
|
[IRI]A:725 |
3 |
1 |
293 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
95749 |
50.3 |
-1.0 |
0.259 |
2 |
0 |
0 |
0.008 |
57 |
|
[IRI]A:740 |
4 |
1 |
295 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
95749 |
49.8 |
-1.8 |
0.137 |
2 |
0 |
0 |
0.000 |
58 |
|
[IRI]A:725 |
4 |
1 |
293 |
◊ |
[IRI]A:724 |
x,y,z |
1_555 |
3 |
1 |
293 |
48.9 |
0.8 |
0.153 |
0 |
0 |
0 |
0.000 |
59 |
|
[IRI]A:881 |
4 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
8 |
2 |
95749 |
48.3 |
-0.9 |
0.191 |
2 |
0 |
0 |
0.007 |
60 |
|
[NA]A:829 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
95749 |
42.6 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.021 |
61 |
|
[NA]A:835 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
95749 |
38.6 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.020 |
62 |
|
[NA]A:834 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
95749 |
36.4 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.016 |
63 |
|
A |
6 |
2 |
95749 |
◊ |
[IRI]A:881 |
-x,-y,z-1/2 |
2_554 |
2 |
1 |
294 |
34.1 |
-0.2 |
0.393 |
0 |
0 |
0 |
0.000 |
64 |
|
[IRI]A:715 |
3 |
1 |
295 |
f |
[IRI]A:706 |
x,y,z |
1_555 |
3 |
1 |
294 |
28.5 |
0.2 |
0.354 |
0 |
0 |
0 |
0.000 |
65 |
|
[NA]A:837 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
95749 |
26.8 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.015 |
66 |
|
[IRI]A:738 |
1 |
1 |
294 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
4 |
2 |
95749 |
25.0 |
0.1 |
0.537 |
0 |
0 |
0 |
0.000 |
67 |
|
[IRI]A:725 |
2 |
1 |
293 |
◊ |
[IRI]A:881 |
-x,-y,z-1/2 |
2_554 |
2 |
1 |
294 |
22.7 |
0.6 |
0.250 |
0 |
0 |
0 |
0.000 |
68 |
|
[IRI]A:707 |
3 |
1 |
293 |
◊ |
A |
x,-y,-z |
4_555 |
5 |
3 |
95749 |
21.9 |
-0.5 |
0.748 |
0 |
0 |
0 |
0.002 |
69 |
|
[IRI]A:880 |
3 |
1 |
294 |
◊ |
A |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
2 |
1 |
95749 |
20.8 |
-0.9 |
0.528 |
1 |
0 |
0 |
0.000 |
70 |
|
[IRI]A:722 |
1 |
1 |
294 |
f |
[IRI]A:721 |
x,y,z |
1_555 |
2 |
1 |
294 |
20.2 |
0.1 |
0.500 |
0 |
0 |
0 |
0.000 |
71 |
|
[IRI]A:712 |
1 |
1 |
292 |
f |
[IRI]A:711 |
x,y,z |
1_555 |
2 |
1 |
294 |
17.7 |
0.0 |
0.500 |
0 |
0 |
0 |
0.000 |
72 |
|
[IRI]A:708 |
1 |
1 |
295 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
5 |
2 |
95749 |
17.6 |
-0.2 |
0.801 |
0 |
0 |
0 |
0.000 |
73 |
|
[IRI]A:734 |
1 |
1 |
293 |
f |
[IRI]A:718 |
x,y,z |
1_555 |
2 |
1 |
295 |
10.4 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
74 |
|
[IRI]A:738 |
1 |
1 |
294 |
f |
[IRI]A:728 |
x,y,z |
1_555 |
2 |
1 |
295 |
8.5 |
0.1 |
0.354 |
0 |
0 |
0 |
0.000 |
75 |
|
[NA]A:837 |
1 |
1 |
125 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
1 |
1 |
95749 |
7.0 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.004 |
76 |
|
[IRI]A:727 |
2 |
1 |
295 |
◊ |
A |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
2 |
2 |
95749 |
1.2 |
-0.1 |
0.687 |
0 |
0 |
0 |
0.000 |
77 |
|
[IRI]A:882 |
1 |
1 |
295 |
◊ |
A |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
1 |
1 |
95749 |
1.0 |
-0.0 |
0.591 |
0 |
0 |
0 |
0.000 |
|