| ## |
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 |
|
D |
124 |
35 |
12118 |
◊ |
C |
x,y,z |
1_555 |
122 |
34 |
12170 |
1243.8 |
-14.8 |
0.151 |
10 |
5 |
0 |
0.111 |
2 |
|
B |
123 |
34 |
12055 |
◊ |
A |
x,y,z |
1_555 |
122 |
35 |
12065 |
1208.3 |
-14.4 |
0.135 |
9 |
5 |
0 |
0.111 |
| Average: |
1226.0 |
-14.6 |
0.143 |
10 |
5 |
0 |
0.111 |
| 2 |
3 |
|
C |
80 |
25 |
12170 |
◊ |
A |
x,y,z |
1_555 |
81 |
25 |
12065 |
722.1 |
-10.0 |
0.171 |
0 |
0 |
0 |
0.055 |
4 |
|
D |
78 |
23 |
12118 |
◊ |
B |
x,y,z |
1_555 |
77 |
23 |
12055 |
695.4 |
-11.2 |
0.119 |
0 |
0 |
0 |
0.055 |
| Average: |
708.7 |
-10.6 |
0.145 |
0 |
0 |
0 |
0.055 |
| 3 |
5 |
|
A |
68 |
23 |
12065 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
69 |
19 |
12170 |
575.6 |
-1.8 |
0.462 |
7 |
3 |
0 |
0.000 |
| 4 |
6 |
|
B |
53 |
19 |
12055 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
56 |
20 |
12118 |
474.9 |
-2.5 |
0.567 |
4 |
2 |
0 |
0.012 |
| 5 |
7 |
|
B |
50 |
15 |
12055 |
◊ |
D |
x-1,y,z |
1_455 |
43 |
16 |
12118 |
439.8 |
-5.2 |
0.278 |
0 |
0 |
0 |
0.025 |
| 6 |
8 |
|
C |
48 |
15 |
12170 |
◊ |
B |
x,y,z |
1_555 |
46 |
15 |
12055 |
436.5 |
5.2 |
0.951 |
9 |
2 |
0 |
0.000 |
9 |
|
D |
46 |
15 |
12118 |
◊ |
A |
x,y,z |
1_555 |
46 |
15 |
12065 |
431.2 |
5.2 |
0.950 |
7 |
2 |
0 |
0.000 |
| Average: |
433.8 |
5.2 |
0.950 |
8 |
2 |
0 |
0.000 |
| 7 |
10 |
|
A |
12 |
5 |
12065 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
12 |
5 |
12118 |
129.5 |
-1.2 |
0.355 |
1 |
0 |
0 |
0.004 |
| 8 |
11 |
|
C |
17 |
7 |
12170 |
◊ |
D |
x-1,y,z-1 |
1_454 |
14 |
5 |
12118 |
109.5 |
1.7 |
0.842 |
1 |
2 |
0 |
0.000 |
| 9 |
12 |
|
A |
11 |
4 |
12065 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
13 |
5 |
12170 |
91.9 |
-0.4 |
0.562 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
A |
6 |
3 |
12065 |
◊ |
B |
x,y,z-1 |
1_554 |
8 |
4 |
12055 |
72.1 |
1.5 |
0.881 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[ZN]C:2002 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
6 |
12170 |
46.9 |
-33.7 |
0.000 |
0 |
0 |
0 |
0.375 |
15 |
|
[ZN]B:2002 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
6 |
12055 |
46.6 |
-33.8 |
0.000 |
0 |
0 |
0 |
0.375 |
16 |
|
[ZN]A:2002 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
12065 |
46.5 |
-33.9 |
0.000 |
0 |
0 |
0 |
0.375 |
17 |
|
[ZN]D:2002 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
8 |
6 |
12118 |
45.9 |
-33.8 |
0.000 |
0 |
0 |
0 |
0.375 |
| Average: |
46.5 |
-33.8 |
0.000 |
0 |
0 |
0 |
0.375 |
| 12 |
18 |
|
[ZN]B:2001 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
6 |
12055 |
46.3 |
-33.8 |
0.000 |
0 |
0 |
0 |
0.376 |
19 |
|
[ZN]C:2001 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
6 |
6 |
12170 |
46.1 |
-33.8 |
0.000 |
0 |
0 |
0 |
0.376 |
20 |
|
[ZN]D:2001 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
8 |
6 |
12118 |
45.9 |
-33.9 |
0.000 |
0 |
0 |
0 |
0.376 |
21 |
|
[ZN]A:2001 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
12065 |
45.6 |
-33.9 |
0.000 |
0 |
0 |
0 |
0.376 |
| Average: |
46.0 |
-33.9 |
0.000 |
0 |
0 |
0 |
0.376 |
| 13 |
22 |
|
[ZN]B:3001 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
12055 |
43.8 |
-21.1 |
0.000 |
0 |
0 |
0 |
0.185 |
23 |
|
[ZN]B:3001 |
1 |
1 |
98 |
◊ |
D |
x-1,y,z |
1_455 |
8 |
4 |
12118 |
38.8 |
-17.2 |
0.000 |
0 |
0 |
0 |
0.185 |
| Average: |
41.3 |
-19.2 |
0.000 |
0 |
0 |
0 |
0.185 |
| 14 |
24 |
|
[MG]B:4002 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
12055 |
38.9 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.023 |
| 15 |
25 |
|
B |
3 |
1 |
12055 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
4 |
2 |
12170 |
31.1 |
-1.0 |
0.213 |
0 |
0 |
0 |
0.000 |
| 16 |
26 |
|
B |
6 |
3 |
12055 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
3 |
12065 |
24.8 |
0.6 |
0.737 |
0 |
0 |
0 |
0.000 |
| 17 |
27 |
|
A |
4 |
1 |
12065 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
2 |
2 |
12118 |
24.5 |
0.4 |
0.809 |
0 |
0 |
0 |
0.000 |
| 18 |
28 |
|
[MG]D:4001 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
12118 |
20.9 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.019 |
29 |
|
B |
4 |
2 |
12055 |
◊ |
[MG]D:4001 |
x-1,y,z |
1_455 |
1 |
1 |
98 |
19.7 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.019 |
| Average: |
20.3 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.019 |
| 19 |
30 |
|
[MG]B:4002 |
1 |
1 |
98 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
12118 |
16.0 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.005 |
| 20 |
31 |
|
[ZN]A:2002 |
1 |
1 |
98 |
f |
[ZN]A:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.7 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.068 |
| 21 |
32 |
|
[ZN]D:2002 |
1 |
1 |
98 |
f |
[ZN]D:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.5 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.069 |
| 22 |
33 |
|
[ZN]C:2002 |
1 |
1 |
98 |
f |
[ZN]C:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.5 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.069 |
| 23 |
34 |
|
[ZN]B:2002 |
1 |
1 |
98 |
f |
[ZN]B:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.4 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.067 |
|