| ## |
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 |
|
B |
112 |
12 |
3109 |
◊ |
A |
x,y,z |
1_555 |
112 |
38 |
30095 |
1036.0 |
-0.3 |
0.845 |
23 |
0 |
0 |
0.000 |
2 |
|
C |
110 |
12 |
3097 |
◊ |
D |
x,y,z |
1_555 |
109 |
39 |
29975 |
1035.9 |
-1.9 |
0.781 |
25 |
0 |
0 |
0.000 |
| Average: |
1035.9 |
-1.1 |
0.813 |
24 |
0 |
0 |
0.000 |
| 2 |
3 |
|
D |
104 |
29 |
29975 |
◊ |
A |
x,y,z |
1_555 |
107 |
29 |
30095 |
911.5 |
5.0 |
0.798 |
10 |
6 |
0 |
0.000 |
| 3 |
4 |
|
A |
43 |
17 |
30095 |
x |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
60 |
12 |
30095 |
488.4 |
-5.4 |
0.071 |
6 |
0 |
0 |
0.000 |
| 4 |
5 |
|
C |
49 |
9 |
3097 |
◊ |
A |
x,y,z |
1_555 |
49 |
13 |
30095 |
435.2 |
-5.9 |
0.475 |
7 |
0 |
0 |
0.000 |
6 |
|
B |
48 |
9 |
3109 |
◊ |
D |
x,y,z |
1_555 |
48 |
14 |
29975 |
435.2 |
-5.9 |
0.476 |
8 |
0 |
0 |
0.000 |
| Average: |
435.2 |
-5.9 |
0.475 |
8 |
0 |
0 |
0.000 |
| 5 |
7 |
|
D |
45 |
16 |
29975 |
x |
D |
x-1/2,-y-1/2,-z |
4_445 |
42 |
12 |
29975 |
417.0 |
-6.1 |
0.058 |
1 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[NAG]D:905 |
12 |
1 |
359 |
cf |
D |
x,y,z |
1_555 |
30 |
9 |
29975 |
180.5 |
5.4 |
0.544 |
2 |
0 |
0 |
0.000 |
9 |
|
[NAG]A:904 |
12 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
26 |
9 |
30095 |
179.2 |
5.5 |
0.519 |
2 |
0 |
0 |
0.000 |
| Average: |
179.9 |
5.4 |
0.531 |
2 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[NAG]D:901 |
14 |
1 |
364 |
cf |
D |
x,y,z |
1_555 |
24 |
10 |
29975 |
174.8 |
5.0 |
0.412 |
0 |
0 |
0 |
0.000 |
11 |
|
[NAG]A:901 |
14 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
23 |
9 |
30095 |
174.1 |
5.1 |
0.374 |
1 |
0 |
0 |
0.000 |
| Average: |
174.4 |
5.1 |
0.393 |
1 |
0 |
0 |
0.000 |
| 8 |
12 |
|
[NAG]D:910 |
12 |
1 |
364 |
cf |
D |
x,y,z |
1_555 |
24 |
12 |
29975 |
164.5 |
4.5 |
0.409 |
2 |
0 |
0 |
0.000 |
| 9 |
13 |
|
[NAG]A:907 |
11 |
1 |
357 |
cf |
A |
x,y,z |
1_555 |
20 |
12 |
30095 |
161.7 |
4.6 |
0.486 |
1 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[NAG]D:912 |
13 |
1 |
358 |
cf |
D |
x,y,z |
1_555 |
23 |
7 |
29975 |
149.2 |
3.8 |
0.313 |
1 |
0 |
0 |
0.000 |
| 11 |
15 |
|
[NAG]D:914 |
14 |
1 |
360 |
cf |
D |
x,y,z |
1_555 |
22 |
9 |
29975 |
146.8 |
3.7 |
0.297 |
1 |
0 |
0 |
0.000 |
| 12 |
16 |
|
[NAG]A:909 |
12 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
24 |
7 |
30095 |
146.6 |
3.6 |
0.352 |
1 |
0 |
0 |
0.000 |
| 13 |
17 |
|
[NAG]D:908 |
11 |
1 |
359 |
cf |
D |
x,y,z |
1_555 |
19 |
7 |
29975 |
143.6 |
4.8 |
0.452 |
1 |
0 |
0 |
0.000 |
| 14 |
18 |
|
D |
18 |
6 |
29975 |
◊ |
[NAG]A:913 |
-x-1,y-1/2,-z+1/2 |
3_445 |
11 |
1 |
362 |
143.5 |
4.0 |
0.388 |
5 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[NAG]D:906 |
11 |
1 |
362 |
cf |
D |
x,y,z |
1_555 |
16 |
7 |
29975 |
136.3 |
4.9 |
0.534 |
0 |
0 |
0 |
0.000 |
20 |
|
[NAG]A:905 |
10 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
15 |
7 |
30095 |
132.7 |
4.6 |
0.539 |
0 |
0 |
0 |
0.000 |
| Average: |
134.5 |
4.7 |
0.536 |
0 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[NAG]A:911 |
12 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
25 |
9 |
30095 |
135.0 |
2.0 |
0.216 |
1 |
0 |
0 |
0.000 |
| 17 |
22 |
|
[NAG]D:917 |
11 |
1 |
361 |
cf |
D |
x,y,z |
1_555 |
18 |
7 |
29975 |
133.3 |
3.4 |
0.338 |
0 |
0 |
0 |
0.000 |
23 |
|
[NAG]A:915 |
10 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
17 |
7 |
30095 |
124.9 |
3.4 |
0.432 |
0 |
0 |
0 |
0.000 |
| Average: |
129.1 |
3.4 |
0.385 |
0 |
0 |
0 |
0.000 |
| 18 |
24 |
|
[NAG]A:906 |
11 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
12 |
7 |
30095 |
130.7 |
3.4 |
0.377 |
1 |
0 |
0 |
0.000 |
25 |
|
[NAG]D:909 |
11 |
1 |
359 |
cf |
D |
x,y,z |
1_555 |
12 |
7 |
29975 |
126.9 |
3.4 |
0.396 |
1 |
0 |
0 |
0.000 |
| Average: |
128.8 |
3.4 |
0.387 |
1 |
0 |
0 |
0.000 |
| 19 |
26 |
|
[NAG]A:910 |
11 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
21 |
6 |
30095 |
129.8 |
3.8 |
0.407 |
0 |
0 |
0 |
0.000 |
| 20 |
27 |
|
[NAG]D:913 |
12 |
1 |
362 |
cf |
D |
x,y,z |
1_555 |
21 |
4 |
29975 |
126.3 |
3.6 |
0.348 |
0 |
0 |
0 |
0.000 |
| 21 |
28 |
|
[NAG]A:912 |
10 |
1 |
365 |
cf |
A |
x,y,z |
1_555 |
12 |
5 |
30095 |
121.0 |
4.3 |
0.456 |
1 |
0 |
0 |
0.000 |
29 |
|
[NAG]D:915 |
11 |
1 |
361 |
cf |
D |
x,y,z |
1_555 |
12 |
5 |
29975 |
118.6 |
4.2 |
0.418 |
1 |
0 |
0 |
0.000 |
| Average: |
119.8 |
4.3 |
0.437 |
1 |
0 |
0 |
0.000 |
| 22 |
30 |
|
[NAG]D:903 |
10 |
1 |
362 |
cf |
D |
x,y,z |
1_555 |
15 |
6 |
29975 |
107.0 |
2.4 |
0.318 |
0 |
0 |
0 |
0.000 |
31 |
|
[NAG]A:903 |
8 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
15 |
5 |
30095 |
103.8 |
2.2 |
0.361 |
0 |
0 |
0 |
0.000 |
| Average: |
105.4 |
2.3 |
0.340 |
0 |
0 |
0 |
0.000 |
| 23 |
32 |
|
[NAG]D:904 |
7 |
1 |
359 |
cf |
D |
x,y,z |
1_555 |
12 |
4 |
29975 |
106.3 |
3.6 |
0.600 |
0 |
0 |
0 |
0.000 |
| 24 |
33 |
|
D |
10 |
4 |
29975 |
◊ |
A |
-x-1,y-1/2,-z+1/2 |
3_445 |
12 |
4 |
30095 |
101.8 |
-0.1 |
0.424 |
0 |
0 |
0 |
0.000 |
| 25 |
34 |
|
[NAG]D:916 |
9 |
1 |
360 |
cf |
D |
x,y,z |
1_555 |
13 |
6 |
29975 |
100.7 |
2.7 |
0.378 |
0 |
0 |
0 |
0.000 |
| 26 |
35 |
|
[NAG]D:914 |
9 |
1 |
360 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
13 |
5 |
29975 |
99.1 |
2.2 |
0.324 |
2 |
0 |
0 |
0.000 |
| 27 |
36 |
|
[NAG]A:914 |
6 |
1 |
355 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
30095 |
81.6 |
2.3 |
0.492 |
1 |
0 |
0 |
0.000 |
| 28 |
37 |
|
[NAG]D:902 |
9 |
1 |
364 |
◊ |
C |
x,y,z |
1_555 |
10 |
2 |
3097 |
79.5 |
1.7 |
0.238 |
1 |
0 |
0 |
0.000 |
38 |
|
[NAG]A:902 |
9 |
1 |
363 |
◊ |
B |
x,y,z |
1_555 |
11 |
2 |
3109 |
78.9 |
1.8 |
0.265 |
1 |
0 |
0 |
0.000 |
| Average: |
79.2 |
1.8 |
0.252 |
1 |
0 |
0 |
0.000 |
| 29 |
39 |
|
[NAG]A:902 |
5 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
30095 |
78.7 |
3.0 |
0.633 |
0 |
0 |
0 |
0.000 |
40 |
|
[NAG]D:902 |
5 |
1 |
364 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
29975 |
72.5 |
2.7 |
0.599 |
0 |
0 |
0 |
0.000 |
| Average: |
75.6 |
2.8 |
0.616 |
0 |
0 |
0 |
0.000 |
| 30 |
41 |
|
[NAG]A:902 |
8 |
1 |
363 |
cf |
[NAG]A:901 |
x,y,z |
1_555 |
5 |
1 |
360 |
75.8 |
2.1 |
0.127 |
1 |
0 |
0 |
0.000 |
42 |
|
[NAG]D:902 |
9 |
1 |
364 |
cf |
[NAG]D:901 |
x,y,z |
1_555 |
5 |
1 |
364 |
73.7 |
2.2 |
0.127 |
1 |
0 |
0 |
0.000 |
| Average: |
74.8 |
2.1 |
0.127 |
1 |
0 |
0 |
0.000 |
| 31 |
43 |
|
[NAG]A:908 |
9 |
1 |
361 |
cf |
[NAG]A:907 |
x,y,z |
1_555 |
6 |
1 |
357 |
74.4 |
1.7 |
0.091 |
1 |
0 |
0 |
0.000 |
44 |
|
[NAG]D:911 |
10 |
1 |
357 |
cf |
[NAG]D:910 |
x,y,z |
1_555 |
6 |
1 |
364 |
73.9 |
1.7 |
0.077 |
0 |
0 |
0 |
0.000 |
| Average: |
74.1 |
1.7 |
0.084 |
1 |
0 |
0 |
0.000 |
| 32 |
45 |
|
[NAG]A:913 |
9 |
1 |
362 |
cf |
[NAG]A:912 |
x,y,z |
1_555 |
6 |
1 |
365 |
68.2 |
1.6 |
0.085 |
0 |
0 |
0 |
0.000 |
46 |
|
[NAG]D:907 |
8 |
1 |
362 |
cf |
[NAG]D:906 |
x,y,z |
1_555 |
6 |
1 |
362 |
68.2 |
1.6 |
0.117 |
0 |
0 |
0 |
0.000 |
| Average: |
68.2 |
1.6 |
0.101 |
0 |
0 |
0 |
0.000 |
| 33 |
47 |
|
[NAG]A:901 |
9 |
1 |
360 |
◊ |
B |
x,y,z |
1_555 |
11 |
1 |
3109 |
60.1 |
1.4 |
0.187 |
0 |
0 |
0 |
0.000 |
48 |
|
[NAG]D:901 |
9 |
1 |
364 |
◊ |
C |
x,y,z |
1_555 |
11 |
1 |
3097 |
59.7 |
1.4 |
0.212 |
0 |
0 |
0 |
0.000 |
| Average: |
59.9 |
1.4 |
0.199 |
0 |
0 |
0 |
0.000 |
| 34 |
49 |
|
D |
6 |
3 |
29975 |
◊ |
[NAG]A:912 |
-x-1,y-1/2,-z+1/2 |
3_445 |
7 |
1 |
365 |
57.2 |
0.7 |
0.239 |
2 |
0 |
0 |
0.000 |
| 35 |
50 |
|
D |
6 |
3 |
29975 |
x |
D |
-x,y-1/2,-z+1/2 |
3_545 |
7 |
2 |
29975 |
56.5 |
0.7 |
0.746 |
0 |
0 |
0 |
0.000 |
| 36 |
51 |
|
D |
9 |
2 |
29975 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
8 |
3 |
30095 |
54.9 |
0.7 |
0.692 |
0 |
0 |
0 |
0.000 |
| 37 |
52 |
|
[NAG]D:911 |
4 |
1 |
357 |
f |
D |
x,y,z |
1_555 |
8 |
3 |
29975 |
41.8 |
1.6 |
0.571 |
0 |
0 |
0 |
0.000 |
53 |
|
[NAG]A:908 |
3 |
1 |
361 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
30095 |
39.2 |
1.6 |
0.648 |
0 |
0 |
0 |
0.000 |
| Average: |
40.5 |
1.6 |
0.610 |
0 |
0 |
0 |
0.000 |
| 38 |
54 |
|
[NAG]D:907 |
4 |
1 |
362 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
29975 |
33.6 |
2.1 |
0.552 |
0 |
0 |
0 |
0.000 |
| 39 |
55 |
|
[NAG]D:911 |
2 |
1 |
357 |
f |
[NAG]D:907 |
x,y,z |
1_555 |
4 |
1 |
362 |
31.1 |
1.6 |
0.394 |
0 |
0 |
0 |
0.000 |
| 40 |
56 |
|
[NAG]D:911 |
1 |
1 |
357 |
f |
[NAG]D:906 |
x,y,z |
1_555 |
4 |
1 |
362 |
20.9 |
1.0 |
0.430 |
0 |
0 |
0 |
0.000 |
57 |
|
[NAG]A:908 |
1 |
1 |
361 |
f |
[NAG]A:905 |
x,y,z |
1_555 |
3 |
1 |
361 |
12.3 |
0.6 |
0.411 |
0 |
0 |
0 |
0.000 |
| Average: |
16.6 |
0.8 |
0.421 |
0 |
0 |
0 |
0.000 |
| 41 |
58 |
|
A |
1 |
1 |
30095 |
◊ |
[NAG]D:917 |
x-1,y,z |
1_455 |
2 |
1 |
361 |
6.5 |
0.3 |
0.425 |
0 |
0 |
0 |
0.000 |
| 42 |
59 |
|
[NAG]D:910 |
1 |
1 |
364 |
f |
[NAG]D:909 |
x,y,z |
1_555 |
1 |
1 |
359 |
5.1 |
0.1 |
0.143 |
0 |
0 |
0 |
0.000 |
60 |
|
[NAG]A:907 |
1 |
1 |
357 |
f |
[NAG]A:906 |
x,y,z |
1_555 |
1 |
1 |
362 |
3.7 |
0.1 |
0.143 |
0 |
0 |
0 |
0.000 |
| Average: |
4.4 |
0.1 |
0.143 |
0 |
0 |
0 |
0.000 |
|