| ## |
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 |
91 |
27 |
11698 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
98 |
23 |
11735 |
837.2 |
-5.6 |
0.476 |
10 |
3 |
0 |
0.000 |
2 |
|
A |
88 |
26 |
11735 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
94 |
24 |
11698 |
805.2 |
-8.1 |
0.241 |
6 |
3 |
0 |
0.000 |
| Average: |
821.2 |
-6.8 |
0.359 |
8 |
3 |
0 |
0.000 |
| 2 |
3 |
|
B |
52 |
20 |
11698 |
◊ |
A |
x,y,z |
1_555 |
44 |
20 |
11735 |
417.3 |
-5.2 |
0.254 |
4 |
0 |
0 |
0.000 |
| 3 |
4 |
|
B |
38 |
8 |
11698 |
x |
B |
-x,y-1/2,-z-1/2 |
3_544 |
36 |
9 |
11698 |
312.2 |
-2.3 |
0.504 |
2 |
0 |
0 |
0.000 |
| 4 |
5 |
|
A |
39 |
10 |
11735 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
35 |
10 |
11735 |
310.9 |
-2.6 |
0.423 |
3 |
0 |
0 |
0.000 |
| 5 |
6 |
|
[NAG]B:1 |
13 |
1 |
362 |
◊ |
B |
x,y,z |
1_555 |
29 |
13 |
11698 |
216.2 |
6.6 |
0.637 |
2 |
0 |
0 |
0.000 |
7 |
|
[NAG]A:1 |
13 |
1 |
364 |
◊ |
A |
x,y,z |
1_555 |
30 |
13 |
11735 |
211.3 |
6.7 |
0.628 |
3 |
0 |
0 |
0.000 |
| Average: |
213.7 |
6.7 |
0.632 |
3 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[NAG]B:2 |
14 |
1 |
365 |
◊ |
B |
x,y,z |
1_555 |
36 |
14 |
11698 |
193.0 |
2.9 |
0.329 |
2 |
0 |
0 |
0.000 |
9 |
|
[NAG]A:2 |
14 |
1 |
367 |
◊ |
A |
x,y,z |
1_555 |
34 |
13 |
11735 |
191.8 |
3.2 |
0.339 |
2 |
0 |
0 |
0.000 |
| Average: |
192.4 |
3.1 |
0.334 |
2 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[NAG]B:3 |
14 |
1 |
367 |
◊ |
B |
x,y,z |
1_555 |
27 |
8 |
11698 |
172.9 |
2.2 |
0.213 |
1 |
0 |
0 |
0.000 |
11 |
|
[NAG]A:3 |
14 |
1 |
365 |
◊ |
A |
x,y,z |
1_555 |
27 |
8 |
11735 |
166.0 |
1.9 |
0.218 |
1 |
0 |
0 |
0.000 |
| Average: |
169.4 |
2.1 |
0.216 |
1 |
0 |
0 |
0.000 |
| 8 |
12 |
|
[NDG]B:4 |
12 |
1 |
373 |
◊ |
B |
x,y,z |
1_555 |
27 |
10 |
11698 |
161.6 |
3.1 |
0.372 |
0 |
0 |
0 |
0.000 |
13 |
|
[NDG]A:4 |
12 |
1 |
372 |
◊ |
A |
x,y,z |
1_555 |
30 |
10 |
11735 |
154.2 |
2.7 |
0.368 |
0 |
0 |
0 |
0.000 |
| Average: |
157.9 |
2.9 |
0.370 |
0 |
0 |
0 |
0.000 |
| 9 |
14 |
|
[GOL]B:721 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
11698 |
104.8 |
-0.5 |
0.508 |
2 |
0 |
0 |
0.009 |
| 10 |
15 |
|
B |
13 |
4 |
11698 |
◊ |
[NDG]A:4 |
-x,y-1/2,-z-1/2 |
3_544 |
8 |
1 |
372 |
103.5 |
1.2 |
0.277 |
0 |
0 |
0 |
0.000 |
16 |
|
A |
6 |
3 |
11735 |
◊ |
[NDG]B:4 |
x-1/2,-y-1/2,-z |
4_445 |
8 |
1 |
373 |
88.4 |
1.0 |
0.152 |
1 |
0 |
0 |
0.000 |
| Average: |
95.9 |
1.1 |
0.215 |
1 |
0 |
0 |
0.000 |
| 11 |
17 |
|
[GOL]A:720 |
6 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
16 |
7 |
11735 |
103.1 |
0.2 |
0.675 |
2 |
0 |
0 |
0.000 |
| 12 |
18 |
|
[GOL]B:5 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
11698 |
95.6 |
-0.1 |
0.607 |
1 |
0 |
0 |
0.003 |
| 13 |
19 |
|
[GOL]B:720 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
11698 |
93.8 |
0.7 |
0.734 |
2 |
0 |
0 |
0.000 |
| 14 |
20 |
|
[NDG]B:4 |
8 |
1 |
373 |
cf |
[NAG]B:3 |
x,y,z |
1_555 |
9 |
1 |
367 |
72.7 |
1.9 |
0.050 |
1 |
0 |
0 |
0.000 |
21 |
|
[NDG]A:4 |
8 |
1 |
372 |
cf |
[NAG]A:3 |
x,y,z |
1_555 |
8 |
1 |
365 |
67.5 |
1.7 |
0.065 |
1 |
0 |
0 |
0.000 |
| Average: |
70.1 |
1.8 |
0.057 |
1 |
0 |
0 |
0.000 |
| 15 |
22 |
|
[GOL]A:721 |
5 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
11 |
3 |
11735 |
72.4 |
1.3 |
0.741 |
2 |
0 |
0 |
0.000 |
| 16 |
23 |
|
[NAG]B:2 |
7 |
1 |
365 |
cf |
[NAG]B:1 |
x,y,z |
1_555 |
10 |
1 |
362 |
66.8 |
1.5 |
0.063 |
1 |
0 |
0 |
0.000 |
24 |
|
[NAG]A:2 |
6 |
1 |
367 |
cf |
[NAG]A:1 |
x,y,z |
1_555 |
9 |
1 |
364 |
65.8 |
1.7 |
0.094 |
1 |
0 |
0 |
0.000 |
| Average: |
66.3 |
1.6 |
0.078 |
1 |
0 |
0 |
0.000 |
| 17 |
25 |
|
[SO4]A:719 |
4 |
1 |
187 |
f |
B |
x-1/2,-y-1/2,-z |
4_445 |
10 |
3 |
11698 |
64.1 |
-8.0 |
0.879 |
0 |
0 |
0 |
0.049 |
| 18 |
26 |
|
[NAG]B:3 |
7 |
1 |
367 |
cf |
[NAG]B:2 |
x,y,z |
1_555 |
8 |
1 |
365 |
61.4 |
1.5 |
0.090 |
1 |
0 |
0 |
0.000 |
27 |
|
[NAG]A:3 |
7 |
1 |
365 |
cf |
[NAG]A:2 |
x,y,z |
1_555 |
8 |
1 |
367 |
57.6 |
1.5 |
0.105 |
1 |
0 |
0 |
0.000 |
| Average: |
59.5 |
1.5 |
0.098 |
1 |
0 |
0 |
0.000 |
| 19 |
28 |
|
[GOL]A:720 |
5 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
11698 |
60.7 |
-0.4 |
0.518 |
1 |
0 |
0 |
0.005 |
| 20 |
29 |
|
[MG]A:718 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
15 |
9 |
11735 |
60.3 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.215 |
30 |
|
[MG]B:718 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
14 |
9 |
11698 |
59.4 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.215 |
| Average: |
59.8 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.215 |
| 21 |
31 |
|
[SO4]A:719 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
11735 |
57.9 |
-7.1 |
0.849 |
0 |
0 |
0 |
0.000 |
| 22 |
32 |
|
[GOL]A:721 |
2 |
1 |
218 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
10 |
4 |
11698 |
44.6 |
-0.5 |
0.390 |
0 |
0 |
0 |
0.000 |
| 23 |
33 |
|
[GOL]B:721 |
4 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
11735 |
42.9 |
0.6 |
0.692 |
1 |
0 |
0 |
0.000 |
| 24 |
34 |
|
[GOL]B:721 |
5 |
1 |
220 |
f |
[GOL]A:720 |
x,y,z |
1_555 |
5 |
1 |
220 |
36.9 |
0.1 |
0.554 |
1 |
0 |
0 |
0.002 |
| 25 |
35 |
|
[NAG]A:3 |
1 |
1 |
365 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
11698 |
28.9 |
1.0 |
0.781 |
0 |
0 |
0 |
0.000 |
| 26 |
36 |
|
[GOL]A:721 |
2 |
1 |
218 |
◊ |
[SO4]A:719 |
x,y,z |
1_555 |
4 |
1 |
187 |
28.5 |
-3.7 |
0.500 |
0 |
0 |
0 |
0.000 |
| 27 |
37 |
|
[NDG]A:4 |
2 |
1 |
372 |
f |
B |
x,y,z |
1_555 |
4 |
1 |
11698 |
20.5 |
0.3 |
0.317 |
1 |
0 |
0 |
0.001 |
| 28 |
38 |
|
[NAG]B:3 |
1 |
1 |
367 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
11735 |
16.9 |
0.6 |
0.760 |
0 |
0 |
0 |
0.000 |
| 29 |
39 |
|
B |
2 |
1 |
11698 |
◊ |
[NAG]A:3 |
-x,y-1/2,-z-1/2 |
3_544 |
2 |
1 |
365 |
16.5 |
0.2 |
0.327 |
0 |
0 |
0 |
0.000 |
| 30 |
40 |
|
[NAG]A:3 |
2 |
1 |
365 |
f |
[NAG]A:1 |
x,y,z |
1_555 |
2 |
1 |
364 |
15.3 |
0.6 |
0.266 |
0 |
0 |
0 |
0.000 |
41 |
|
[NAG]B:3 |
2 |
1 |
367 |
f |
[NAG]B:1 |
x,y,z |
1_555 |
2 |
1 |
362 |
14.8 |
0.5 |
0.276 |
0 |
0 |
0 |
0.000 |
| Average: |
15.0 |
0.5 |
0.271 |
0 |
0 |
0 |
0.000 |
| 31 |
42 |
|
[NDG]B:4 |
2 |
1 |
373 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
11735 |
13.8 |
0.2 |
0.274 |
0 |
0 |
0 |
0.000 |
|