| ## |
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 |
151 |
37 |
11075 |
◊ |
B |
x,y,z |
1_555 |
147 |
36 |
10879 |
1408.5 |
-11.6 |
0.607 |
27 |
8 |
0 |
0.211 |
2 |
|
D |
146 |
36 |
10933 |
◊ |
A |
x,y,z |
1_555 |
149 |
36 |
11212 |
1366.1 |
-11.1 |
0.624 |
28 |
8 |
0 |
0.211 |
| Average: |
1387.3 |
-11.3 |
0.616 |
28 |
8 |
0 |
0.211 |
| 2 |
3 |
|
A |
68 |
17 |
11212 |
◊ |
C |
x,y,z-1 |
1_554 |
68 |
17 |
11075 |
623.1 |
1.1 |
0.912 |
12 |
6 |
0 |
0.000 |
| 3 |
4 |
|
A |
61 |
20 |
11212 |
◊ |
D |
-y+1,x-y,z |
2_655 |
58 |
20 |
10933 |
590.6 |
0.4 |
0.870 |
14 |
8 |
0 |
0.056 |
5 |
|
B |
57 |
20 |
10879 |
◊ |
C |
-y+1,x-y,z |
2_655 |
58 |
20 |
11075 |
590.3 |
-0.0 |
0.860 |
14 |
8 |
0 |
0.056 |
| Average: |
590.5 |
0.2 |
0.865 |
14 |
8 |
0 |
0.056 |
| 4 |
6 |
|
D |
49 |
12 |
10933 |
◊ |
A |
x+2/3,y+1/3,z+1/3 |
4_555 |
39 |
11 |
11212 |
408.3 |
-7.1 |
0.233 |
2 |
0 |
0 |
0.000 |
| 5 |
7 |
|
D |
18 |
5 |
10933 |
x |
D |
-y+1,x-y,z |
2_655 |
31 |
10 |
10933 |
256.0 |
-3.3 |
0.268 |
0 |
0 |
0 |
0.024 |
| 6 |
8 |
|
C |
22 |
6 |
11075 |
x |
C |
-y+1,x-y,z |
2_655 |
32 |
9 |
11075 |
254.3 |
-3.9 |
0.357 |
2 |
0 |
0 |
0.067 |
9 |
|
B |
30 |
8 |
10879 |
x |
B |
-y+1,x-y,z |
2_655 |
20 |
6 |
10879 |
249.9 |
-4.2 |
0.275 |
0 |
0 |
0 |
0.067 |
10 |
|
A |
30 |
8 |
11212 |
x |
A |
-y+1,x-y,z |
2_655 |
20 |
5 |
11212 |
244.6 |
-3.9 |
0.315 |
2 |
0 |
0 |
0.067 |
| Average: |
249.6 |
-4.0 |
0.316 |
1 |
0 |
0 |
0.067 |
| 7 |
11 |
|
D |
24 |
6 |
10933 |
◊ |
B |
-y+1,x-y,z |
2_655 |
29 |
7 |
10879 |
212.8 |
0.1 |
0.770 |
2 |
0 |
0 |
0.000 |
| 8 |
12 |
|
A |
21 |
7 |
11212 |
◊ |
C |
-y+2/3,x-y+1/3,z-2/3 |
5_554 |
20 |
5 |
11075 |
191.0 |
-1.9 |
0.503 |
0 |
0 |
0 |
0.000 |
| 9 |
13 |
|
[NAG]B:1223 |
14 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
27 |
10 |
10879 |
171.6 |
3.3 |
0.342 |
2 |
0 |
0 |
0.000 |
14 |
|
[NAG]D:1223 |
14 |
1 |
355 |
cf |
D |
x,y,z |
1_555 |
27 |
10 |
10933 |
168.9 |
2.7 |
0.321 |
2 |
0 |
0 |
0.000 |
15 |
|
[NAG]A:1223 |
14 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
24 |
10 |
11212 |
167.3 |
2.9 |
0.323 |
2 |
0 |
0 |
0.000 |
16 |
|
[NAG]C:1224 |
14 |
1 |
359 |
cf |
C |
x,y,z |
1_555 |
26 |
10 |
11075 |
167.0 |
3.0 |
0.317 |
2 |
0 |
0 |
0.000 |
| Average: |
168.7 |
3.0 |
0.326 |
2 |
0 |
0 |
0.000 |
| 10 |
17 |
|
[NAG]C:1225 |
9 |
1 |
360 |
f |
C |
x,y,z |
1_555 |
15 |
3 |
11075 |
112.5 |
2.0 |
0.346 |
1 |
0 |
0 |
0.000 |
| 11 |
18 |
|
[NAG]B:1224 |
10 |
1 |
363 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
10879 |
110.8 |
1.9 |
0.359 |
1 |
0 |
0 |
0.000 |
19 |
|
[NAG]D:1224 |
10 |
1 |
359 |
f |
D |
x,y,z |
1_555 |
15 |
5 |
10933 |
106.4 |
2.1 |
0.339 |
1 |
0 |
0 |
0.000 |
20 |
|
[NAG]A:1224 |
10 |
1 |
358 |
f |
A |
x,y,z |
1_555 |
14 |
3 |
11212 |
103.4 |
0.7 |
0.221 |
1 |
0 |
0 |
0.000 |
| Average: |
106.9 |
1.6 |
0.306 |
1 |
0 |
0 |
0.000 |
| 12 |
21 |
|
C |
13 |
3 |
11075 |
◊ |
B |
-y+2/3,x-y-2/3,z+1/3 |
5_545 |
11 |
3 |
10879 |
81.5 |
-0.9 |
0.571 |
0 |
0 |
0 |
0.000 |
| 13 |
22 |
|
[NAG]A:1224 |
9 |
1 |
358 |
cf |
[NAG]A:1223 |
x,y,z |
1_555 |
7 |
1 |
363 |
70.8 |
1.3 |
0.079 |
0 |
0 |
0 |
0.000 |
23 |
|
[NAG]C:1225 |
10 |
1 |
360 |
cf |
[NAG]C:1224 |
x,y,z |
1_555 |
6 |
1 |
359 |
70.3 |
1.5 |
0.069 |
0 |
0 |
0 |
0.000 |
24 |
|
[NAG]D:1224 |
10 |
1 |
359 |
cf |
[NAG]D:1223 |
x,y,z |
1_555 |
6 |
1 |
355 |
69.4 |
1.5 |
0.081 |
0 |
0 |
0 |
0.000 |
25 |
|
[NAG]B:1224 |
10 |
1 |
363 |
cf |
[NAG]B:1223 |
x,y,z |
1_555 |
6 |
1 |
363 |
68.8 |
1.4 |
0.086 |
0 |
0 |
0 |
0.000 |
| Average: |
69.8 |
1.4 |
0.079 |
0 |
0 |
0 |
0.000 |
| 14 |
26 |
|
D |
8 |
6 |
10933 |
◊ |
C |
x+2/3,y+1/3,z-2/3 |
4_554 |
8 |
2 |
11075 |
64.2 |
0.0 |
0.707 |
0 |
0 |
0 |
0.000 |
| 15 |
27 |
|
[PT]B:1222 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
10879 |
63.0 |
-23.2 |
0.000 |
0 |
0 |
0 |
0.396 |
28 |
|
[PT]D:1221 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
7 |
2 |
10933 |
62.9 |
-23.4 |
0.000 |
0 |
0 |
0 |
0.396 |
29 |
|
[PT]C:1222 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
6 |
2 |
11075 |
62.8 |
-23.2 |
0.000 |
0 |
0 |
0 |
0.396 |
30 |
|
[PT]A:1221 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
11212 |
62.7 |
-22.3 |
0.000 |
0 |
0 |
0 |
0.396 |
| Average: |
62.8 |
-23.0 |
0.000 |
0 |
0 |
0 |
0.396 |
| 16 |
31 |
|
[PT]B:1221 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
10879 |
62.2 |
-20.8 |
0.000 |
0 |
0 |
0 |
0.334 |
32 |
|
[PT]D:1220 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
7 |
3 |
10933 |
60.4 |
-18.8 |
0.000 |
0 |
0 |
0 |
0.334 |
33 |
|
[PT]C:1221 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
11075 |
59.6 |
-18.3 |
0.000 |
0 |
0 |
0 |
0.334 |
34 |
|
[PT]A:1220 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
11212 |
57.9 |
-16.7 |
0.000 |
0 |
0 |
0 |
0.334 |
| Average: |
60.0 |
-18.7 |
0.000 |
0 |
0 |
0 |
0.334 |
| 17 |
35 |
|
[PT]D:1222 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
10933 |
58.8 |
-16.2 |
0.000 |
0 |
0 |
0 |
0.135 |
| 18 |
36 |
|
[MAN]A:1225 |
6 |
1 |
291 |
f |
[NAG]A:1224 |
x,y,z |
1_555 |
4 |
1 |
358 |
57.5 |
1.2 |
0.169 |
0 |
0 |
0 |
0.000 |
| 19 |
37 |
|
[MAN]D:1225 |
6 |
1 |
296 |
f |
[NAG]D:1224 |
x,y,z |
1_555 |
5 |
1 |
359 |
57.3 |
1.0 |
0.118 |
0 |
0 |
0 |
0.000 |
38 |
|
[MAN]B:1225 |
6 |
1 |
292 |
f |
[NAG]B:1224 |
x,y,z |
1_555 |
5 |
1 |
363 |
56.6 |
1.1 |
0.132 |
0 |
0 |
0 |
0.000 |
39 |
|
[MAN]C:1226 |
5 |
1 |
296 |
f |
[NAG]C:1225 |
x,y,z |
1_555 |
5 |
1 |
360 |
55.9 |
1.1 |
0.131 |
0 |
0 |
0 |
0.000 |
| Average: |
56.6 |
1.1 |
0.127 |
0 |
0 |
0 |
0.000 |
| 20 |
40 |
|
C |
7 |
6 |
11075 |
◊ |
B |
x-1/3,y+1/3,z+1/3 |
4_455 |
8 |
4 |
10879 |
51.1 |
-0.3 |
0.626 |
0 |
0 |
0 |
0.000 |
| 21 |
41 |
|
[PT]B:1226 |
1 |
1 |
125 |
f |
B |
x-1/3,y+1/3,z+1/3 |
4_455 |
4 |
2 |
10879 |
46.1 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.093 |
| 22 |
42 |
|
[PT]A:1222 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
11212 |
39.9 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.074 |
43 |
|
[PT]C:1223 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
11075 |
38.5 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.074 |
| Average: |
39.2 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.074 |
| 23 |
44 |
|
A |
4 |
2 |
11212 |
◊ |
[PT]C:1223 |
-y+2/3,x-y+1/3,z-2/3 |
5_554 |
1 |
1 |
125 |
32.1 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 24 |
45 |
|
[PT]B:1226 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
11075 |
31.4 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 25 |
46 |
|
C |
3 |
2 |
11075 |
◊ |
D |
-x+y+2/3,-x+4/3,z+1/3 |
6_565 |
1 |
1 |
10933 |
11.5 |
0.2 |
0.793 |
0 |
0 |
0 |
0.000 |
| 26 |
47 |
|
[PT]A:1222 |
1 |
1 |
125 |
◊ |
D |
-y+1,x-y,z |
2_655 |
1 |
1 |
10933 |
6.9 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.010 |
|