| ## |
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 |
304 |
74 |
27101 |
◊ |
A |
x,y,z |
1_555 |
315 |
79 |
26967 |
2790.2 |
-9.3 |
0.365 |
59 |
16 |
0 |
0.473 |
| 2 |
2 |
|
A |
68 |
25 |
26967 |
◊ |
A |
-x,y,-z |
2_555 |
69 |
26 |
26967 |
613.2 |
-2.9 |
0.379 |
4 |
2 |
0 |
0.000 |
| 3 |
3 |
|
B |
52 |
18 |
27101 |
◊ |
A |
-x-1/2,y-1/2,-z-1/2 |
4_444 |
54 |
19 |
26967 |
465.6 |
-4.9 |
0.166 |
7 |
0 |
0 |
0.000 |
| 4 |
4 |
|
A |
24 |
7 |
26967 |
◊ |
A |
-x-1,y,-z |
2_455 |
24 |
7 |
26967 |
216.1 |
2.9 |
0.888 |
4 |
2 |
0 |
0.000 |
5 |
|
B |
22 |
7 |
27101 |
◊ |
B |
-x-1,y,-z |
2_455 |
22 |
7 |
27101 |
169.1 |
1.1 |
0.743 |
2 |
0 |
0 |
0.000 |
| Average: |
192.6 |
2.0 |
0.816 |
3 |
1 |
0 |
0.000 |
| 5 |
6 |
|
[LGC]B:802 |
12 |
1 |
302 |
f |
B |
x,y,z |
1_555 |
25 |
13 |
27101 |
175.9 |
3.6 |
0.549 |
7 |
0 |
0 |
0.000 |
7 |
|
[LGC]A:801 |
12 |
1 |
302 |
f |
A |
x,y,z |
1_555 |
29 |
13 |
26967 |
174.3 |
3.6 |
0.555 |
6 |
0 |
0 |
0.000 |
| Average: |
175.1 |
3.6 |
0.552 |
7 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[LGC]B:803 |
11 |
1 |
306 |
◊ |
B |
x,y,z |
1_555 |
26 |
8 |
27101 |
159.1 |
1.4 |
0.260 |
3 |
0 |
0 |
0.000 |
9 |
|
[LGC]A:802 |
10 |
1 |
302 |
◊ |
A |
x,y,z |
1_555 |
23 |
7 |
26967 |
148.5 |
1.5 |
0.323 |
3 |
0 |
0 |
0.000 |
| Average: |
153.8 |
1.5 |
0.291 |
3 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[LGC]B:804 |
12 |
1 |
304 |
f |
B |
x,y,z |
1_555 |
30 |
10 |
27101 |
149.5 |
1.6 |
0.266 |
5 |
0 |
0 |
0.008 |
| 8 |
11 |
|
[PEG]B:801 |
7 |
1 |
263 |
◊ |
B |
x,y,z |
1_555 |
24 |
11 |
27101 |
149.5 |
4.0 |
0.501 |
4 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[GOL]B:807 |
6 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
26 |
12 |
27101 |
147.3 |
-0.1 |
0.619 |
4 |
0 |
0 |
0.023 |
| 10 |
13 |
|
B |
16 |
6 |
27101 |
◊ |
A |
-x-1,y,-z |
2_455 |
17 |
6 |
26967 |
145.5 |
0.2 |
0.633 |
4 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[GOL]A:805 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
26967 |
108.3 |
0.3 |
0.656 |
4 |
0 |
0 |
0.018 |
| 12 |
15 |
|
[GOL]B:806 |
5 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
19 |
6 |
27101 |
105.2 |
-1.4 |
0.361 |
1 |
0 |
0 |
0.023 |
| 13 |
16 |
|
[GOL]A:804 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
19 |
6 |
26967 |
93.6 |
-0.8 |
0.461 |
1 |
0 |
0 |
0.015 |
| 14 |
17 |
|
B |
9 |
3 |
27101 |
◊ |
A |
x-1,y,z |
1_455 |
10 |
5 |
26967 |
88.5 |
0.3 |
0.559 |
1 |
0 |
0 |
0.000 |
| 15 |
18 |
|
[GOL]A:806 |
5 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
17 |
5 |
27101 |
87.3 |
-0.7 |
0.438 |
1 |
0 |
0 |
0.014 |
| 16 |
19 |
|
[PEG]B:801 |
6 |
1 |
263 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
26967 |
75.9 |
0.2 |
0.165 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
[SO4]B:808 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
26967 |
66.1 |
-8.5 |
0.721 |
2 |
0 |
0 |
0.117 |
| 18 |
21 |
|
[GOL]A:806 |
6 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
11 |
2 |
26967 |
64.9 |
0.2 |
0.629 |
2 |
0 |
0 |
0.008 |
| 19 |
22 |
|
[SO4]B:808 |
5 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
27101 |
64.7 |
-8.4 |
0.751 |
2 |
0 |
0 |
0.116 |
| 20 |
23 |
|
[GOL]A:804 |
6 |
1 |
220 |
◊ |
B |
x,y,z |
1_555 |
10 |
2 |
27101 |
64.7 |
0.0 |
0.602 |
1 |
0 |
0 |
0.005 |
| 21 |
24 |
|
[MG]A:803 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
8 |
26967 |
56.4 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.235 |
25 |
|
[MG]B:805 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
27101 |
56.3 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.235 |
| Average: |
56.3 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.235 |
| 22 |
26 |
|
[LGC]A:802 |
7 |
1 |
302 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
27101 |
51.9 |
1.8 |
0.439 |
0 |
0 |
0 |
0.000 |
27 |
|
[LGC]B:803 |
7 |
1 |
306 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
26967 |
47.9 |
1.1 |
0.321 |
0 |
0 |
0 |
0.000 |
| Average: |
49.9 |
1.4 |
0.380 |
0 |
0 |
0 |
0.000 |
| 23 |
28 |
|
[GOL]B:806 |
4 |
1 |
218 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
26967 |
44.7 |
-0.2 |
0.434 |
0 |
0 |
0 |
0.002 |
| 24 |
29 |
|
[LGC]B:804 |
8 |
1 |
304 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
26967 |
43.1 |
1.4 |
0.332 |
0 |
0 |
0 |
0.000 |
| 25 |
30 |
|
B |
9 |
4 |
27101 |
x |
B |
-x-3/2,y-1/2,-z-1/2 |
4_344 |
4 |
3 |
27101 |
42.6 |
-0.0 |
0.447 |
0 |
0 |
0 |
0.000 |
| 26 |
31 |
|
[GOL]A:804 |
4 |
1 |
220 |
f |
[LGC]A:801 |
x,y,z |
1_555 |
5 |
1 |
302 |
40.3 |
0.3 |
0.297 |
2 |
0 |
0 |
0.008 |
| 27 |
32 |
|
[GOL]A:806 |
4 |
1 |
221 |
f |
[LGC]B:802 |
x,y,z |
1_555 |
5 |
1 |
302 |
39.1 |
-0.1 |
0.262 |
1 |
0 |
0 |
0.007 |
| 28 |
33 |
|
B |
5 |
2 |
27101 |
◊ |
A |
x,y-1,z |
1_545 |
5 |
2 |
26967 |
31.7 |
0.9 |
0.801 |
0 |
0 |
0 |
0.000 |
| 29 |
34 |
|
[SO4]B:808 |
4 |
1 |
187 |
f |
[LGC]B:803 |
x,y,z |
1_555 |
4 |
1 |
306 |
25.3 |
-2.2 |
0.348 |
0 |
0 |
0 |
0.028 |
| 30 |
35 |
|
[SO4]B:808 |
4 |
1 |
187 |
◊ |
[LGC]A:802 |
x,y,z |
1_555 |
3 |
1 |
302 |
18.0 |
-1.4 |
0.494 |
0 |
0 |
0 |
0.017 |
| 31 |
36 |
|
[LGC]A:801 |
1 |
1 |
302 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
27101 |
14.0 |
0.5 |
0.373 |
0 |
0 |
0 |
0.000 |
37 |
|
[LGC]B:802 |
1 |
1 |
302 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
26967 |
12.2 |
0.4 |
0.369 |
0 |
0 |
0 |
0.000 |
| Average: |
13.1 |
0.4 |
0.371 |
0 |
0 |
0 |
0.000 |
| 32 |
38 |
|
[GOL]A:806 |
2 |
1 |
221 |
f |
[LGC]B:804 |
x,y,z |
1_555 |
2 |
1 |
304 |
10.4 |
0.0 |
0.403 |
0 |
0 |
0 |
0.000 |
|