| ## |
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 |
139 |
40 |
19780 |
◊ |
A |
x,y,z |
1_555 |
133 |
45 |
19844 |
1174.2 |
-14.2 |
0.114 |
7 |
1 |
0 |
1.000 |
2 |
|
D |
132 |
42 |
19817 |
◊ |
C |
x,y,z |
1_555 |
128 |
38 |
19823 |
1128.4 |
-14.4 |
0.104 |
6 |
1 |
0 |
1.000 |
| Average: |
1151.3 |
-14.3 |
0.109 |
7 |
1 |
0 |
1.000 |
| 2 |
3 |
|
C |
57 |
18 |
19823 |
◊ |
B |
x,y,z |
1_555 |
49 |
16 |
19780 |
537.2 |
-1.4 |
0.548 |
4 |
3 |
0 |
0.000 |
4 |
|
B |
56 |
19 |
19780 |
◊ |
C |
x-1,y,z |
1_455 |
50 |
15 |
19823 |
535.2 |
-1.2 |
0.560 |
2 |
3 |
0 |
0.000 |
| Average: |
536.2 |
-1.3 |
0.554 |
3 |
3 |
0 |
0.000 |
| 3 |
5 |
|
A |
46 |
15 |
19844 |
◊ |
D |
x-1,y-1,z-1 |
1_444 |
41 |
15 |
19817 |
405.1 |
-1.3 |
0.561 |
1 |
0 |
0 |
0.000 |
| 4 |
6 |
|
B |
32 |
12 |
19780 |
◊ |
D |
x,y-1,z |
1_545 |
30 |
12 |
19817 |
284.7 |
-0.2 |
0.567 |
3 |
0 |
0 |
0.000 |
7 |
|
A |
26 |
11 |
19844 |
◊ |
C |
x-1,y-1,z |
1_445 |
26 |
9 |
19823 |
276.1 |
0.5 |
0.620 |
0 |
1 |
0 |
0.000 |
| Average: |
280.4 |
0.2 |
0.594 |
2 |
1 |
0 |
0.000 |
| 5 |
8 |
|
[NAG]C:401 |
13 |
1 |
362 |
cf |
C |
x,y,z |
1_555 |
22 |
8 |
19823 |
176.0 |
3.9 |
0.396 |
2 |
0 |
0 |
0.000 |
9 |
|
[NAG]A:401 |
12 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
21 |
8 |
19844 |
158.2 |
3.7 |
0.400 |
2 |
0 |
0 |
0.000 |
10 |
|
[NAG]D:401 |
12 |
1 |
363 |
cf |
D |
x,y,z |
1_555 |
21 |
8 |
19817 |
156.6 |
3.6 |
0.388 |
1 |
0 |
0 |
0.000 |
| Average: |
163.6 |
3.7 |
0.394 |
2 |
0 |
0 |
0.000 |
| 6 |
11 |
|
[NAG]B:401 |
13 |
1 |
365 |
cf |
B |
x,y,z |
1_555 |
22 |
8 |
19780 |
171.6 |
3.7 |
0.401 |
1 |
0 |
0 |
0.000 |
| 7 |
12 |
|
D |
17 |
5 |
19817 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
19780 |
138.9 |
0.1 |
0.597 |
0 |
0 |
0 |
0.000 |
13 |
|
A |
11 |
3 |
19844 |
◊ |
C |
x-1,y,z |
1_455 |
10 |
4 |
19823 |
68.7 |
-1.2 |
0.364 |
0 |
0 |
0 |
0.000 |
| Average: |
103.8 |
-0.6 |
0.481 |
0 |
0 |
0 |
0.000 |
| 8 |
14 |
|
[NAG]A:403 |
11 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
15 |
7 |
19844 |
127.1 |
3.4 |
0.397 |
0 |
0 |
0 |
0.000 |
| 9 |
15 |
|
[NAG]B:403 |
12 |
1 |
362 |
cf |
B |
x,y,z |
1_555 |
19 |
8 |
19780 |
124.9 |
3.0 |
0.314 |
0 |
0 |
0 |
0.000 |
| 10 |
16 |
|
[NAG]D:403 |
10 |
1 |
361 |
cf |
D |
x,y,z |
1_555 |
15 |
7 |
19817 |
122.8 |
3.2 |
0.438 |
0 |
0 |
0 |
0.000 |
| 11 |
17 |
|
B |
15 |
5 |
19780 |
◊ |
C |
x-1,y-1,z |
1_445 |
11 |
3 |
19823 |
115.5 |
0.7 |
0.720 |
0 |
0 |
0 |
0.000 |
18 |
|
B |
13 |
2 |
19780 |
◊ |
C |
x,y-1,z |
1_545 |
11 |
3 |
19823 |
98.8 |
0.5 |
0.664 |
0 |
0 |
0 |
0.000 |
| Average: |
107.2 |
0.6 |
0.692 |
0 |
0 |
0 |
0.000 |
| 12 |
19 |
|
[NAG]A:402 |
6 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
14 |
3 |
19844 |
92.7 |
1.8 |
0.411 |
0 |
0 |
0 |
0.000 |
20 |
|
[NAG]D:402 |
6 |
1 |
362 |
f |
D |
x,y,z |
1_555 |
13 |
3 |
19817 |
92.5 |
1.8 |
0.378 |
0 |
0 |
0 |
0.000 |
| Average: |
92.6 |
1.8 |
0.394 |
0 |
0 |
0 |
0.000 |
| 13 |
21 |
|
B |
11 |
4 |
19780 |
◊ |
A |
x-1,y,z |
1_455 |
14 |
6 |
19844 |
92.1 |
0.2 |
0.664 |
0 |
0 |
0 |
0.000 |
22 |
|
C |
8 |
3 |
19823 |
◊ |
D |
x-1,y,z |
1_455 |
14 |
5 |
19817 |
90.1 |
0.5 |
0.716 |
0 |
0 |
0 |
0.000 |
| Average: |
91.1 |
0.3 |
0.690 |
0 |
0 |
0 |
0.000 |
| 14 |
23 |
|
B |
14 |
5 |
19780 |
◊ |
D |
x-1,y,z |
1_455 |
12 |
4 |
19817 |
91.5 |
-1.0 |
0.438 |
0 |
0 |
0 |
0.000 |
24 |
|
C |
12 |
4 |
19823 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
19844 |
88.3 |
-1.2 |
0.383 |
0 |
0 |
0 |
0.000 |
| Average: |
89.9 |
-1.1 |
0.411 |
0 |
0 |
0 |
0.000 |
| 15 |
25 |
|
[NAG]B:402 |
10 |
1 |
353 |
cf |
[NAG]B:401 |
x,y,z |
1_555 |
9 |
1 |
365 |
80.5 |
2.1 |
0.061 |
0 |
0 |
0 |
0.000 |
| 16 |
26 |
|
B |
8 |
3 |
19780 |
◊ |
D |
x-1,y-1,z |
1_445 |
10 |
4 |
19817 |
79.5 |
-0.0 |
0.588 |
0 |
0 |
0 |
0.000 |
| 17 |
27 |
|
[NAG]C:402 |
8 |
1 |
364 |
cf |
[NAG]C:401 |
x,y,z |
1_555 |
6 |
1 |
362 |
74.9 |
2.2 |
0.143 |
0 |
0 |
0 |
0.000 |
| 18 |
28 |
|
B |
10 |
3 |
19780 |
◊ |
[NAG]D:403 |
x-1,y,z |
1_455 |
4 |
1 |
361 |
69.8 |
1.1 |
0.409 |
0 |
0 |
0 |
0.000 |
| 19 |
29 |
|
[NAG]D:402 |
8 |
1 |
362 |
cf |
[NAG]D:401 |
x,y,z |
1_555 |
6 |
1 |
363 |
68.9 |
1.4 |
0.093 |
0 |
0 |
0 |
0.000 |
| 20 |
30 |
|
[NAG]A:402 |
9 |
1 |
363 |
cf |
[NAG]A:401 |
x,y,z |
1_555 |
6 |
1 |
362 |
68.1 |
1.3 |
0.095 |
0 |
0 |
0 |
0.000 |
| 21 |
31 |
|
[NAG]A:403 |
4 |
1 |
364 |
◊ |
C |
x,y,z |
1_555 |
10 |
3 |
19823 |
65.0 |
1.0 |
0.413 |
0 |
0 |
0 |
0.000 |
| 22 |
32 |
|
[CL]C:403 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
19823 |
58.6 |
-7.2 |
0.000 |
0 |
0 |
0 |
1.000 |
33 |
|
[CL]B:404 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
19780 |
58.5 |
-7.3 |
0.000 |
0 |
0 |
0 |
1.000 |
| Average: |
58.6 |
-7.2 |
0.000 |
0 |
0 |
0 |
1.000 |
| 23 |
34 |
|
B |
8 |
4 |
19780 |
◊ |
[CL]C:403 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
43.9 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.000 |
35 |
|
[CL]B:404 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
19823 |
42.7 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
43.3 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 24 |
36 |
|
[NAG]C:402 |
2 |
1 |
364 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
19844 |
40.4 |
0.9 |
0.659 |
1 |
0 |
0 |
0.000 |
| 25 |
37 |
|
[NAG]C:402 |
6 |
1 |
364 |
f |
C |
x,y,z |
1_555 |
3 |
2 |
19823 |
35.8 |
0.7 |
0.274 |
0 |
0 |
0 |
0.000 |
| 26 |
38 |
|
[NAG]B:401 |
5 |
1 |
365 |
◊ |
D |
x-1,y,z |
1_455 |
7 |
4 |
19817 |
35.6 |
1.2 |
0.417 |
0 |
0 |
0 |
0.000 |
| 27 |
39 |
|
[NAG]B:402 |
2 |
1 |
353 |
◊ |
D |
x-1,y,z |
1_455 |
6 |
3 |
19817 |
34.7 |
0.8 |
0.578 |
0 |
0 |
0 |
0.000 |
| 28 |
40 |
|
[NAG]C:401 |
5 |
1 |
362 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
19844 |
34.6 |
1.2 |
0.410 |
0 |
0 |
0 |
0.000 |
| 29 |
41 |
|
[NAG]B:402 |
5 |
1 |
353 |
f |
B |
x,y,z |
1_555 |
2 |
1 |
19780 |
33.1 |
0.8 |
0.300 |
0 |
0 |
0 |
0.000 |
| 30 |
42 |
|
[NAG]B:401 |
3 |
1 |
365 |
◊ |
[NAG]D:403 |
x-1,y,z |
1_455 |
3 |
1 |
361 |
32.1 |
1.4 |
0.298 |
0 |
0 |
0 |
0.000 |
43 |
|
[NAG]C:401 |
2 |
1 |
362 |
◊ |
[NAG]A:403 |
x,y,z |
1_555 |
3 |
1 |
364 |
27.5 |
1.1 |
0.377 |
0 |
0 |
0 |
0.000 |
| Average: |
29.8 |
1.2 |
0.337 |
0 |
0 |
0 |
0.000 |
| 31 |
44 |
|
[NAG]C:402 |
2 |
1 |
364 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
19780 |
13.6 |
0.1 |
0.316 |
0 |
0 |
0 |
0.000 |
| 32 |
45 |
|
[NAG]B:402 |
3 |
1 |
353 |
◊ |
C |
x-1,y,z |
1_455 |
2 |
1 |
19823 |
7.5 |
0.1 |
0.269 |
0 |
0 |
0 |
0.000 |
| 33 |
46 |
|
[NAG]D:401 |
1 |
1 |
363 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
19823 |
4.7 |
-0.0 |
0.219 |
0 |
0 |
0 |
0.003 |
47 |
|
[NAG]A:401 |
1 |
1 |
362 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
19780 |
3.5 |
-0.0 |
0.232 |
0 |
0 |
0 |
0.003 |
| Average: |
4.1 |
-0.0 |
0.226 |
0 |
0 |
0 |
0.003 |
|