## |
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 |
|
C |
199 |
58 |
15067 |
◊ |
B |
x,y,z |
1_555 |
216 |
57 |
16158 |
1921.5 |
-20.8 |
0.121 |
23 |
5 |
1 |
0.549 |
2 |
|
F |
188 |
56 |
14278 |
◊ |
E |
x,y,z |
1_555 |
206 |
53 |
15725 |
1768.6 |
-20.4 |
0.113 |
21 |
3 |
1 |
0.549 |
Average: |
1845.1 |
-20.6 |
0.117 |
22 |
4 |
1 |
0.549 |
2 |
3 |
|
B |
177 |
44 |
16158 |
◊ |
A |
x,y,z |
1_555 |
182 |
48 |
5941 |
1784.1 |
-24.5 |
0.050 |
17 |
10 |
1 |
0.719 |
4 |
|
E |
173 |
41 |
15725 |
◊ |
D |
x,y,z |
1_555 |
166 |
41 |
4869 |
1617.9 |
-20.6 |
0.063 |
18 |
8 |
1 |
0.719 |
Average: |
1701.0 |
-22.5 |
0.057 |
18 |
9 |
1 |
0.719 |
3 |
5 |
|
C |
78 |
22 |
15067 |
◊ |
A |
x,y,z |
1_555 |
80 |
22 |
5941 |
801.9 |
-14.9 |
0.030 |
10 |
3 |
1 |
0.664 |
6 |
|
F |
58 |
18 |
14278 |
◊ |
D |
x,y,z |
1_555 |
63 |
17 |
4869 |
607.0 |
-12.7 |
0.026 |
11 |
2 |
1 |
0.664 |
Average: |
704.4 |
-13.8 |
0.028 |
11 |
3 |
1 |
0.664 |
4 |
7 |
|
F |
48 |
16 |
14278 |
◊ |
C |
x,y,z |
1_555 |
53 |
16 |
15067 |
450.5 |
-6.8 |
0.191 |
0 |
0 |
0 |
0.000 |
5 |
8 |
|
C |
49 |
15 |
15067 |
◊ |
F |
x-1/2,-y+3/2,-z+1 |
4_466 |
44 |
13 |
14278 |
390.9 |
-0.0 |
0.709 |
4 |
1 |
0 |
0.000 |
6 |
9 |
|
E |
40 |
12 |
15725 |
◊ |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
44 |
13 |
16158 |
362.5 |
-0.6 |
0.639 |
5 |
1 |
0 |
0.000 |
7 |
10 |
|
G |
25 |
4 |
639 |
◊ |
C |
x,y,z |
1_555 |
52 |
15 |
15067 |
358.0 |
-0.8 |
0.619 |
7 |
4 |
0 |
0.116 |
11 |
|
H |
24 |
4 |
641 |
◊ |
F |
x,y,z |
1_555 |
52 |
16 |
14278 |
349.8 |
-0.0 |
0.711 |
8 |
4 |
0 |
0.116 |
Average: |
353.9 |
-0.4 |
0.665 |
8 |
4 |
0 |
0.116 |
8 |
12 |
|
E |
20 |
7 |
15725 |
◊ |
B |
-x+5/2,-y+1,z-1/2 |
2_764 |
28 |
10 |
16158 |
213.8 |
1.1 |
0.731 |
1 |
0 |
0 |
0.000 |
9 |
13 |
|
F |
27 |
12 |
14278 |
◊ |
C |
-x+3/2,-y+1,z-1/2 |
2_664 |
26 |
11 |
15067 |
212.1 |
0.5 |
0.735 |
0 |
0 |
0 |
0.000 |
10 |
14 |
|
D |
13 |
3 |
4869 |
◊ |
B |
-x+5/2,-y+1,z-1/2 |
2_764 |
18 |
7 |
16158 |
171.1 |
0.4 |
0.683 |
4 |
0 |
0 |
0.000 |
11 |
15 |
|
F |
16 |
5 |
14278 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
24 |
7 |
5941 |
150.4 |
-1.2 |
0.526 |
1 |
0 |
0 |
0.000 |
12 |
16 |
|
B |
19 |
6 |
16158 |
x |
B |
x-1,y,z |
1_455 |
19 |
10 |
16158 |
142.5 |
-0.2 |
0.604 |
0 |
0 |
0 |
0.000 |
13 |
17 |
|
E |
8 |
2 |
15725 |
◊ |
B |
-x+3/2,-y+1,z-1/2 |
2_664 |
15 |
4 |
16158 |
109.9 |
3.2 |
0.918 |
3 |
4 |
0 |
0.000 |
14 |
18 |
|
[NAG]E:470 |
9 |
1 |
349 |
cf |
E |
x,y,z |
1_555 |
13 |
5 |
15725 |
106.3 |
2.3 |
0.323 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[NAG]B:470 |
10 |
1 |
357 |
cf |
B |
x,y,z |
1_555 |
14 |
5 |
16158 |
104.8 |
2.1 |
0.299 |
2 |
0 |
0 |
0.000 |
16 |
20 |
|
[NDG]E:471 |
7 |
1 |
361 |
cf |
[NAG]E:470 |
x,y,z |
1_555 |
10 |
1 |
349 |
90.4 |
3.7 |
0.112 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
[NAG]B:471 |
8 |
1 |
356 |
cf |
[NAG]B:470 |
x,y,z |
1_555 |
8 |
1 |
357 |
83.2 |
2.2 |
0.096 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
E |
9 |
5 |
15725 |
◊ |
C |
x-1/2,-y+3/2,-z+1 |
4_466 |
6 |
3 |
15067 |
58.0 |
-1.4 |
0.276 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
E |
7 |
2 |
15725 |
◊ |
C |
-x+3/2,-y+1,z-1/2 |
2_664 |
6 |
2 |
15067 |
58.0 |
1.4 |
0.865 |
2 |
0 |
0 |
0.000 |
20 |
24 |
|
[NH2]H:5 |
1 |
1 |
117 |
cf |
H |
x,y,z |
1_555 |
6 |
2 |
641 |
54.8 |
0.4 |
0.735 |
0 |
0 |
0 |
0.000 |
25 |
|
[NH2]G:5 |
1 |
1 |
117 |
cf |
G |
x,y,z |
1_555 |
7 |
2 |
639 |
53.4 |
0.4 |
0.753 |
0 |
0 |
0 |
0.000 |
Average: |
54.1 |
0.4 |
0.744 |
0 |
0 |
0 |
0.000 |
21 |
26 |
|
[CA]B:2 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
16158 |
48.4 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.236 |
27 |
|
[CA]E:2 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
11 |
6 |
15725 |
46.7 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.236 |
Average: |
47.6 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.236 |
22 |
28 |
|
[CA]C:4 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
15067 |
45.8 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.239 |
23 |
29 |
|
[CA]C:1 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
15067 |
45.0 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.336 |
30 |
|
[CA]F:1 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
7 |
5 |
14278 |
44.3 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.336 |
Average: |
44.6 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.336 |
24 |
31 |
|
[CA]E:3 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
7 |
5 |
15725 |
38.1 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.175 |
32 |
|
[CA]B:3 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
5 |
4 |
16158 |
36.9 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.175 |
Average: |
37.5 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.175 |
25 |
33 |
|
[NH2]H:5 |
1 |
1 |
117 |
◊ |
F |
x,y,z |
1_555 |
5 |
3 |
14278 |
31.7 |
0.7 |
0.899 |
0 |
0 |
0 |
0.000 |
34 |
|
[NH2]G:5 |
1 |
1 |
117 |
◊ |
C |
x,y,z |
1_555 |
6 |
4 |
15067 |
27.2 |
0.1 |
0.702 |
0 |
0 |
0 |
0.000 |
Average: |
29.5 |
0.4 |
0.800 |
0 |
0 |
0 |
0.000 |
26 |
35 |
|
[CA]B:3 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
15067 |
26.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.062 |
36 |
|
[CA]E:3 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
5 |
2 |
14278 |
26.6 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.062 |
Average: |
26.7 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.062 |
27 |
37 |
|
C |
1 |
1 |
15067 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
16158 |
15.8 |
0.3 |
0.387 |
0 |
0 |
0 |
0.000 |
28 |
38 |
|
F |
2 |
1 |
14278 |
x |
F |
x-1,y,z |
1_455 |
1 |
1 |
14278 |
12.5 |
-0.4 |
0.256 |
0 |
0 |
0 |
0.000 |
29 |
39 |
|
C |
3 |
1 |
15067 |
◊ |
E |
x-1/2,-y+3/2,-z+1 |
4_466 |
3 |
1 |
15725 |
11.4 |
-0.1 |
0.560 |
0 |
0 |
0 |
0.000 |
30 |
40 |
|
C |
1 |
1 |
15067 |
◊ |
H |
x-1/2,-y+3/2,-z+1 |
4_466 |
2 |
1 |
641 |
7.3 |
-0.0 |
0.686 |
0 |
0 |
0 |
0.000 |
31 |
41 |
|
G |
1 |
1 |
639 |
◊ |
F |
x-1/2,-y+3/2,-z+1 |
4_466 |
1 |
1 |
14278 |
7.2 |
0.1 |
0.751 |
0 |
0 |
0 |
0.000 |
32 |
42 |
|
[NDG]E:471 |
2 |
1 |
361 |
f |
E |
x,y,z |
1_555 |
1 |
1 |
15725 |
4.1 |
0.2 |
0.286 |
0 |
0 |
0 |
0.000 |
33 |
43 |
|
[CA]B:3 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
5941 |
2.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.007 |
|