| ## |
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 |
47 |
15 |
6958 |
◊ |
A |
-x+1,y-1/2,-z+2 |
2_647 |
51 |
15 |
7248 |
464.5 |
-4.7 |
0.209 |
4 |
0 |
0 |
0.000 |
| 2 |
2 |
|
[5BW]B:1605 |
23 |
1 |
542 |
f |
B |
x,y,z |
1_555 |
42 |
16 |
6958 |
308.9 |
-7.1 |
0.386 |
2 |
0 |
0 |
0.036 |
3 |
|
[5BW]A:1605 |
23 |
1 |
544 |
f |
A |
x,y,z |
1_555 |
42 |
15 |
7248 |
308.3 |
-6.8 |
0.377 |
2 |
0 |
0 |
0.036 |
| Average: |
308.6 |
-7.0 |
0.382 |
2 |
0 |
0 |
0.036 |
| 3 |
4 |
|
A |
36 |
11 |
7248 |
◊ |
B |
x,y,z-1 |
1_554 |
31 |
12 |
6958 |
280.6 |
0.6 |
0.562 |
1 |
0 |
0 |
0.000 |
5 |
|
B |
33 |
9 |
6958 |
◊ |
A |
x,y,z |
1_555 |
30 |
10 |
7248 |
270.4 |
0.6 |
0.534 |
2 |
0 |
0 |
0.000 |
| Average: |
275.5 |
0.6 |
0.548 |
2 |
0 |
0 |
0.000 |
| 4 |
6 |
|
B |
20 |
5 |
6958 |
◊ |
A |
x-1,y,z |
1_455 |
15 |
3 |
7248 |
145.6 |
0.3 |
0.556 |
1 |
3 |
0 |
0.000 |
| 5 |
7 |
|
[EDO]A:1602 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
16 |
5 |
7248 |
101.1 |
3.3 |
0.466 |
2 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[EDO]A:1603 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
25 |
9 |
7248 |
100.7 |
2.0 |
0.232 |
3 |
0 |
0 |
0.000 |
| 7 |
9 |
|
A |
9 |
3 |
7248 |
x |
A |
x-1,y,z |
1_455 |
14 |
4 |
7248 |
80.6 |
0.5 |
0.541 |
1 |
1 |
0 |
0.000 |
| 8 |
10 |
|
A |
6 |
2 |
7248 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
9 |
3 |
7248 |
77.3 |
3.0 |
0.848 |
2 |
4 |
0 |
0.000 |
11 |
|
B |
4 |
2 |
6958 |
x |
B |
-x+1,y-1/2,-z+2 |
2_647 |
3 |
1 |
6958 |
27.9 |
0.0 |
0.544 |
0 |
0 |
0 |
0.000 |
| Average: |
52.6 |
1.5 |
0.696 |
1 |
2 |
0 |
0.000 |
| 9 |
12 |
|
[EDO]B:1602 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
6958 |
53.2 |
1.2 |
0.805 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
A |
6 |
3 |
7248 |
◊ |
[EDO]B:1604 |
x,y,z-1 |
1_554 |
4 |
1 |
184 |
50.5 |
1.4 |
0.863 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[EDO]A:1604 |
3 |
1 |
183 |
f |
[EDO]B:1604 |
x,y,z-1 |
1_554 |
3 |
1 |
184 |
41.6 |
2.3 |
1.000 |
0 |
0 |
0 |
0.000 |
| 12 |
15 |
|
[EDO]B:1603 |
3 |
1 |
184 |
f |
[EDO]B:1602 |
x,y,z |
1_555 |
3 |
1 |
184 |
39.1 |
2.2 |
1.000 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[ZN]A:1601 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
7248 |
37.5 |
-17.9 |
0.000 |
0 |
0 |
0 |
0.083 |
17 |
|
[ZN]B:1601 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
6958 |
36.5 |
-16.9 |
0.000 |
0 |
0 |
0 |
0.083 |
| Average: |
37.0 |
-17.4 |
0.000 |
0 |
0 |
0 |
0.083 |
| 14 |
18 |
|
[EDO]B:1603 |
2 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
6958 |
37.5 |
1.5 |
0.601 |
0 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[ZN]B:1601 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
7248 |
34.6 |
-14.6 |
0.000 |
0 |
0 |
0 |
0.000 |
20 |
|
[ZN]A:1601 |
1 |
1 |
98 |
◊ |
B |
x,y,z-1 |
1_554 |
7 |
4 |
6958 |
33.9 |
-14.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
34.2 |
-14.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[EDO]A:1604 |
3 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
7248 |
29.7 |
1.2 |
0.910 |
0 |
0 |
0 |
0.000 |
| 17 |
22 |
|
[EDO]B:1604 |
3 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
6958 |
28.4 |
1.0 |
0.900 |
1 |
0 |
0 |
0.000 |
| 18 |
23 |
|
[EDO]B:1602 |
2 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
7248 |
28.4 |
1.1 |
0.886 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
[EDO]A:1602 |
1 |
1 |
182 |
f |
B |
x,y,z-1 |
1_554 |
1 |
1 |
6958 |
5.5 |
-0.0 |
0.580 |
0 |
0 |
0 |
0.000 |
| 20 |
25 |
|
[EDO]B:1603 |
2 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
7248 |
5.0 |
0.1 |
0.886 |
0 |
0 |
0 |
0.000 |
| 21 |
26 |
|
[EDO]A:1604 |
1 |
1 |
183 |
f |
B |
x,y,z-1 |
1_554 |
1 |
1 |
6958 |
4.0 |
0.1 |
0.878 |
0 |
0 |
0 |
0.000 |
| 22 |
27 |
|
A |
2 |
2 |
7248 |
◊ |
B |
x-1,y,z-1 |
1_454 |
1 |
1 |
6958 |
1.4 |
0.1 |
0.728 |
0 |
0 |
0 |
0.000 |
|