## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
H |
98 |
24 |
5419 |
◊ |
G |
x,y,z |
1_555 |
97 |
24 |
5413 |
843.1 |
-8.6 |
0.244 |
20 |
4 |
0 |
0.520 |
2 |
|
B |
98 |
25 |
5417 |
◊ |
A |
x,y,z |
1_555 |
96 |
23 |
5424 |
838.2 |
-8.2 |
0.262 |
20 |
4 |
0 |
0.520 |
3 |
|
J |
95 |
23 |
5420 |
◊ |
I |
x,y,z |
1_555 |
96 |
24 |
5418 |
835.8 |
-8.4 |
0.245 |
18 |
3 |
0 |
0.520 |
4 |
|
D |
96 |
24 |
5428 |
◊ |
C |
x,y,z |
1_555 |
97 |
24 |
5430 |
826.9 |
-8.8 |
0.232 |
18 |
3 |
0 |
0.520 |
5 |
|
F |
98 |
24 |
5424 |
◊ |
E |
x,y,z |
1_555 |
96 |
24 |
5422 |
826.6 |
-9.1 |
0.218 |
17 |
3 |
0 |
0.520 |
6 |
|
L |
96 |
24 |
5425 |
◊ |
K |
x,y,z |
1_555 |
98 |
24 |
5415 |
812.2 |
-9.3 |
0.208 |
19 |
2 |
0 |
0.520 |
Average: |
830.5 |
-8.7 |
0.235 |
19 |
3 |
0 |
0.520 |
2 |
7 |
|
[C78]L:166 |
37 |
1 |
811 |
f |
L |
x,y,z |
1_555 |
51 |
13 |
5425 |
390.4 |
-3.0 |
0.535 |
14 |
0 |
0 |
0.616 |
8 |
|
[C78]E:159 |
37 |
1 |
808 |
f |
E |
x,y,z |
1_555 |
51 |
13 |
5422 |
389.4 |
-2.9 |
0.536 |
14 |
0 |
0 |
0.616 |
9 |
|
[C78]K:165 |
37 |
1 |
810 |
f |
K |
x,y,z |
1_555 |
50 |
13 |
5415 |
389.0 |
-3.0 |
0.542 |
14 |
0 |
0 |
0.616 |
10 |
|
[C78]F:160 |
37 |
1 |
807 |
f |
F |
x,y,z |
1_555 |
52 |
13 |
5424 |
388.7 |
-2.9 |
0.541 |
14 |
0 |
0 |
0.616 |
11 |
|
[C78]A:155 |
37 |
1 |
810 |
f |
A |
x,y,z |
1_555 |
51 |
13 |
5424 |
388.5 |
-3.0 |
0.538 |
14 |
0 |
0 |
0.616 |
12 |
|
[C78]D:158 |
37 |
1 |
810 |
f |
D |
x,y,z |
1_555 |
53 |
14 |
5428 |
387.5 |
-3.0 |
0.534 |
14 |
0 |
0 |
0.616 |
13 |
|
[C78]I:163 |
38 |
1 |
807 |
f |
I |
x,y,z |
1_555 |
52 |
13 |
5418 |
387.3 |
-2.9 |
0.543 |
14 |
0 |
0 |
0.616 |
14 |
|
[C78]C:157 |
37 |
1 |
807 |
f |
C |
x,y,z |
1_555 |
50 |
13 |
5430 |
387.1 |
-3.0 |
0.535 |
14 |
0 |
0 |
0.616 |
15 |
|
[C78]H:162 |
37 |
1 |
810 |
f |
H |
x,y,z |
1_555 |
52 |
13 |
5419 |
386.9 |
-1.3 |
0.605 |
14 |
0 |
0 |
0.616 |
16 |
|
[C78]B:156 |
37 |
1 |
809 |
f |
B |
x,y,z |
1_555 |
52 |
13 |
5417 |
384.9 |
-2.9 |
0.533 |
14 |
0 |
0 |
0.616 |
17 |
|
[C78]J:164 |
37 |
1 |
808 |
f |
J |
x,y,z |
1_555 |
51 |
13 |
5420 |
384.9 |
-1.3 |
0.608 |
14 |
0 |
0 |
0.616 |
18 |
|
[C78]G:161 |
38 |
1 |
806 |
f |
G |
x,y,z |
1_555 |
51 |
13 |
5413 |
384.6 |
-2.9 |
0.543 |
14 |
0 |
0 |
0.616 |
Average: |
387.4 |
-2.7 |
0.549 |
14 |
0 |
0 |
0.616 |
3 |
19 |
|
J |
34 |
15 |
5420 |
◊ |
H |
-x,y-1/2,-z+3/2 |
3_546 |
34 |
15 |
5419 |
295.3 |
-2.1 |
0.413 |
2 |
2 |
0 |
0.126 |
20 |
|
B |
35 |
15 |
5417 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
32 |
14 |
5428 |
285.2 |
-1.9 |
0.438 |
2 |
3 |
0 |
0.126 |
21 |
|
C |
31 |
14 |
5430 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
30 |
13 |
5422 |
213.8 |
-0.9 |
0.554 |
1 |
3 |
0 |
0.126 |
22 |
|
K |
27 |
12 |
5415 |
◊ |
G |
x-1/2,-y+1/2,-z+1 |
4_456 |
27 |
13 |
5413 |
196.4 |
-0.7 |
0.565 |
2 |
2 |
0 |
0.126 |
23 |
|
F |
20 |
8 |
5424 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
19 |
8 |
5424 |
162.8 |
-0.0 |
0.631 |
0 |
1 |
0 |
0.126 |
24 |
|
L |
20 |
8 |
5425 |
◊ |
I |
-x+1/2,-y,z-1/2 |
2_554 |
21 |
9 |
5418 |
157.5 |
0.0 |
0.641 |
1 |
1 |
0 |
0.126 |
Average: |
218.5 |
-0.9 |
0.541 |
1 |
2 |
0 |
0.126 |
4 |
25 |
|
A |
29 |
7 |
5424 |
◊ |
G |
-x+1,y-1/2,-z+1/2 |
3_645 |
30 |
10 |
5413 |
273.7 |
3.3 |
0.899 |
5 |
3 |
0 |
0.000 |
26 |
|
F |
29 |
8 |
5424 |
◊ |
C |
x-1/2,-y+3/2,-z+1 |
4_466 |
28 |
8 |
5430 |
273.1 |
2.8 |
0.883 |
5 |
3 |
0 |
0.000 |
Average: |
273.4 |
3.1 |
0.891 |
5 |
3 |
0 |
0.000 |
5 |
27 |
|
D |
30 |
10 |
5428 |
◊ |
J |
-x-1/2,-y+1,z-1/2 |
2_464 |
28 |
9 |
5420 |
263.2 |
-1.3 |
0.523 |
6 |
0 |
0 |
0.000 |
6 |
28 |
|
C |
29 |
11 |
5430 |
◊ |
I |
-x+1/2,-y+1,z-1/2 |
2_564 |
30 |
11 |
5418 |
222.6 |
0.1 |
0.677 |
0 |
0 |
0 |
0.000 |
7 |
29 |
|
[C78]B:156 |
23 |
1 |
809 |
◊ |
[C78]D:158 |
-x,y-1/2,-z+1/2 |
3_545 |
23 |
1 |
810 |
195.1 |
-2.5 |
0.508 |
2 |
0 |
0 |
0.115 |
30 |
|
[C78]F:160 |
26 |
1 |
807 |
◊ |
[C78]A:155 |
x-1/2,-y+1/2,-z+1 |
4_456 |
24 |
1 |
810 |
194.3 |
-2.2 |
0.556 |
2 |
0 |
0 |
0.115 |
31 |
|
[C78]L:166 |
26 |
1 |
811 |
◊ |
[C78]I:163 |
-x+1/2,-y,z-1/2 |
2_554 |
26 |
1 |
807 |
194.2 |
-2.2 |
0.557 |
2 |
0 |
0 |
0.115 |
32 |
|
[C78]K:165 |
24 |
1 |
810 |
◊ |
[C78]G:161 |
x-1/2,-y+1/2,-z+1 |
4_456 |
24 |
1 |
806 |
188.9 |
-2.4 |
0.531 |
2 |
0 |
0 |
0.115 |
33 |
|
[C78]C:157 |
23 |
1 |
807 |
◊ |
[C78]E:159 |
-x+1/2,-y+1,z-1/2 |
2_564 |
24 |
1 |
808 |
186.6 |
-3.1 |
0.460 |
2 |
0 |
0 |
0.115 |
Average: |
191.8 |
-2.5 |
0.522 |
2 |
0 |
0 |
0.115 |
8 |
34 |
|
[C78]J:164 |
23 |
1 |
808 |
◊ |
[C78]H:162 |
-x,y-1/2,-z+3/2 |
3_546 |
23 |
1 |
810 |
189.8 |
-2.3 |
0.526 |
2 |
0 |
0 |
0.121 |
9 |
35 |
|
L |
18 |
7 |
5425 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
21 |
6 |
5424 |
184.2 |
-0.3 |
0.599 |
0 |
0 |
0 |
0.000 |
10 |
36 |
|
D |
23 |
9 |
5428 |
◊ |
E |
x-1/2,-y+3/2,-z+1 |
4_466 |
23 |
8 |
5422 |
176.3 |
3.2 |
0.914 |
3 |
0 |
0 |
0.000 |
37 |
|
B |
19 |
6 |
5417 |
◊ |
H |
-x,y-1/2,-z+1/2 |
3_545 |
18 |
8 |
5419 |
151.5 |
2.8 |
0.904 |
2 |
0 |
0 |
0.000 |
Average: |
163.9 |
3.0 |
0.909 |
3 |
0 |
0 |
0.000 |
11 |
38 |
|
A |
21 |
9 |
5424 |
◊ |
K |
-x,y-1/2,-z+1/2 |
3_545 |
20 |
8 |
5415 |
167.2 |
0.7 |
0.661 |
0 |
0 |
0 |
0.000 |
12 |
39 |
|
J |
25 |
7 |
5420 |
◊ |
E |
-x,y-1/2,-z+3/2 |
3_546 |
13 |
4 |
5422 |
131.2 |
-0.1 |
0.636 |
1 |
0 |
0 |
0.000 |
13 |
40 |
|
L |
17 |
4 |
5425 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
15 |
7 |
5422 |
114.2 |
1.9 |
0.853 |
1 |
0 |
0 |
0.000 |
14 |
41 |
|
B |
10 |
4 |
5417 |
◊ |
K |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
3 |
5415 |
70.4 |
1.6 |
0.784 |
0 |
0 |
0 |
0.000 |
15 |
42 |
|
B |
6 |
2 |
5417 |
◊ |
[C78]D:158 |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
1 |
810 |
65.2 |
-2.5 |
0.122 |
0 |
0 |
0 |
0.083 |
43 |
|
C |
5 |
2 |
5430 |
◊ |
[C78]E:159 |
-x+1/2,-y+1,z-1/2 |
2_564 |
6 |
1 |
808 |
60.2 |
-2.2 |
0.129 |
0 |
0 |
0 |
0.083 |
44 |
|
[C78]L:166 |
6 |
1 |
811 |
◊ |
I |
-x+1/2,-y,z-1/2 |
2_554 |
5 |
2 |
5418 |
59.0 |
-2.2 |
0.139 |
0 |
0 |
0 |
0.083 |
45 |
|
K |
5 |
2 |
5415 |
◊ |
[C78]G:161 |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
1 |
806 |
59.0 |
-2.1 |
0.146 |
0 |
0 |
0 |
0.083 |
46 |
|
[C78]K:165 |
6 |
1 |
810 |
◊ |
G |
x-1/2,-y+1/2,-z+1 |
4_456 |
5 |
2 |
5413 |
57.8 |
-2.1 |
0.150 |
0 |
0 |
0 |
0.083 |
47 |
|
[C78]F:160 |
6 |
1 |
807 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
5 |
2 |
5424 |
57.7 |
-2.1 |
0.148 |
0 |
0 |
0 |
0.083 |
48 |
|
F |
5 |
2 |
5424 |
◊ |
[C78]A:155 |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
1 |
810 |
56.5 |
-2.0 |
0.154 |
0 |
0 |
0 |
0.083 |
49 |
|
L |
5 |
2 |
5425 |
◊ |
[C78]I:163 |
-x+1/2,-y,z-1/2 |
2_554 |
6 |
1 |
807 |
52.0 |
-1.8 |
0.185 |
0 |
0 |
0 |
0.083 |
Average: |
58.4 |
-2.1 |
0.147 |
0 |
0 |
0 |
0.083 |
16 |
50 |
|
[C78]J:164 |
6 |
1 |
808 |
◊ |
H |
-x,y-1/2,-z+3/2 |
3_546 |
5 |
2 |
5419 |
64.5 |
-2.4 |
0.105 |
0 |
0 |
0 |
0.181 |
51 |
|
J |
6 |
2 |
5420 |
◊ |
[C78]H:162 |
-x,y-1/2,-z+3/2 |
3_546 |
6 |
1 |
810 |
62.2 |
-2.3 |
0.137 |
0 |
0 |
0 |
0.181 |
52 |
|
[C78]B:156 |
6 |
1 |
809 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
2 |
5428 |
62.0 |
-2.3 |
0.144 |
0 |
0 |
0 |
0.181 |
53 |
|
[C78]C:157 |
7 |
1 |
807 |
◊ |
E |
-x+1/2,-y+1,z-1/2 |
2_564 |
6 |
3 |
5422 |
53.5 |
-1.8 |
0.226 |
0 |
0 |
0 |
0.181 |
Average: |
60.5 |
-2.2 |
0.153 |
0 |
0 |
0 |
0.181 |
17 |
54 |
|
B |
5 |
2 |
5417 |
◊ |
H |
-x+1/2,-y+1,z-1/2 |
2_564 |
6 |
2 |
5419 |
58.3 |
-0.0 |
0.605 |
0 |
0 |
0 |
0.000 |
18 |
55 |
|
I |
2 |
1 |
5418 |
◊ |
F |
-x,y-1/2,-z+3/2 |
3_546 |
1 |
1 |
5424 |
6.4 |
-0.0 |
0.466 |
0 |
0 |
0 |
0.000 |
|