## |
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 |
|
A |
172 |
43 |
15286 |
◊ |
A |
-x+2,-y,z |
2_755 |
170 |
43 |
15286 |
1566.7 |
-17.1 |
0.045 |
32 |
16 |
0 |
0.246 |
2 |
|
B |
160 |
42 |
15157 |
◊ |
B |
-x+2,-y,z |
2_755 |
158 |
42 |
15157 |
1539.1 |
-15.4 |
0.061 |
34 |
16 |
0 |
0.246 |
Average: |
1552.9 |
-16.2 |
0.053 |
33 |
16 |
0 |
0.246 |
2 |
3 |
|
[NAJ]B:1361 |
43 |
1 |
871 |
f |
B |
x,y,z |
1_555 |
77 |
36 |
15157 |
584.7 |
-8.8 |
0.303 |
14 |
0 |
0 |
0.225 |
4 |
|
[NAJ]A:1361 |
43 |
1 |
867 |
f |
A |
x,y,z |
1_555 |
75 |
36 |
15286 |
583.4 |
-9.5 |
0.254 |
14 |
0 |
0 |
0.225 |
Average: |
584.0 |
-9.2 |
0.279 |
14 |
0 |
0 |
0.225 |
3 |
5 |
|
B |
60 |
16 |
15157 |
◊ |
A |
x,y,z |
1_555 |
59 |
17 |
15286 |
571.7 |
-0.3 |
0.625 |
6 |
2 |
0 |
0.000 |
4 |
6 |
|
B |
63 |
18 |
15157 |
◊ |
A |
-x+2,-y,z |
2_755 |
63 |
18 |
15286 |
514.0 |
-3.1 |
0.414 |
0 |
0 |
0 |
0.000 |
5 |
7 |
|
B |
42 |
13 |
15157 |
◊ |
A |
-x+3/2,y-1/2,-z |
3_645 |
53 |
12 |
15286 |
422.9 |
1.4 |
0.727 |
7 |
13 |
0 |
0.025 |
6 |
8 |
|
B |
34 |
11 |
15157 |
x |
B |
x-1/2,-y-1/2,-z+1 |
4_446 |
34 |
13 |
15157 |
309.6 |
2.0 |
0.786 |
6 |
10 |
0 |
0.000 |
7 |
9 |
|
A |
20 |
5 |
15286 |
x |
A |
-x+3/2,y-1/2,-z |
3_645 |
27 |
7 |
15286 |
209.0 |
0.7 |
0.696 |
3 |
1 |
0 |
0.000 |
8 |
10 |
|
[OCA]B:1360 |
10 |
1 |
345 |
f |
B |
x,y,z |
1_555 |
30 |
14 |
15157 |
178.4 |
3.0 |
0.036 |
3 |
0 |
0 |
0.000 |
11 |
|
[OCA]A:1360 |
10 |
1 |
345 |
f |
A |
x,y,z |
1_555 |
29 |
14 |
15286 |
174.6 |
3.1 |
0.037 |
3 |
0 |
0 |
0.000 |
Average: |
176.5 |
3.1 |
0.037 |
3 |
0 |
0 |
0.000 |
9 |
12 |
|
A |
22 |
8 |
15286 |
◊ |
B |
-x+2,-y,z-1 |
2_754 |
25 |
9 |
15157 |
164.4 |
1.6 |
0.781 |
0 |
0 |
0 |
0.000 |
10 |
13 |
|
A |
14 |
5 |
15286 |
◊ |
B |
x,y,z-1 |
1_554 |
13 |
5 |
15157 |
117.1 |
2.8 |
0.908 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
[OCA]A:1360 |
6 |
1 |
345 |
◊ |
A |
-x+2,-y,z |
2_755 |
7 |
3 |
15286 |
61.3 |
2.2 |
0.000 |
0 |
0 |
0 |
0.000 |
15 |
|
[OCA]B:1360 |
6 |
1 |
345 |
◊ |
B |
-x+2,-y,z |
2_755 |
7 |
3 |
15157 |
59.9 |
1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
60.6 |
2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
12 |
16 |
|
[NAJ]B:1361 |
9 |
1 |
871 |
f |
[OCA]B:1360 |
x,y,z |
1_555 |
6 |
1 |
345 |
46.0 |
0.4 |
0.749 |
0 |
0 |
0 |
0.000 |
17 |
|
[NAJ]A:1361 |
9 |
1 |
867 |
f |
[OCA]A:1360 |
x,y,z |
1_555 |
5 |
1 |
345 |
45.3 |
0.4 |
0.749 |
0 |
0 |
0 |
0.000 |
Average: |
45.6 |
0.4 |
0.749 |
0 |
0 |
0 |
0.000 |
13 |
18 |
|
[ZN]A:1363 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
15286 |
41.4 |
-24.5 |
0.000 |
0 |
0 |
0 |
0.266 |
14 |
19 |
|
A |
3 |
1 |
15286 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
7 |
2 |
15157 |
35.4 |
0.5 |
0.743 |
0 |
0 |
0 |
0.000 |
15 |
20 |
|
[NAJ]B:1361 |
5 |
1 |
871 |
◊ |
B |
-x+2,-y,z |
2_755 |
4 |
1 |
15157 |
34.5 |
-0.2 |
0.328 |
0 |
0 |
0 |
0.004 |
21 |
|
[NAJ]A:1361 |
5 |
1 |
867 |
◊ |
A |
-x+2,-y,z |
2_755 |
4 |
1 |
15286 |
33.8 |
-0.2 |
0.334 |
0 |
0 |
0 |
0.004 |
Average: |
34.2 |
-0.2 |
0.331 |
0 |
0 |
0 |
0.004 |
16 |
22 |
|
B |
3 |
1 |
15157 |
◊ |
[ZN]A:1363 |
-x+3/2,y-1/2,-z |
3_645 |
1 |
1 |
98 |
33.2 |
-14.8 |
0.000 |
0 |
0 |
0 |
0.100 |
17 |
23 |
|
[ZN]B:1362 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
15157 |
31.4 |
-22.6 |
0.000 |
0 |
0 |
0 |
0.338 |
24 |
|
[ZN]A:1362 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
15286 |
31.0 |
-22.5 |
0.000 |
0 |
0 |
0 |
0.338 |
Average: |
31.2 |
-22.6 |
0.000 |
0 |
0 |
0 |
0.338 |
18 |
25 |
|
A |
3 |
1 |
15286 |
◊ |
B |
x-1/2,-y-1/2,-z+1 |
4_446 |
2 |
1 |
15157 |
27.3 |
0.5 |
0.820 |
0 |
1 |
0 |
0.000 |
19 |
26 |
|
[ZN]A:1362 |
1 |
1 |
98 |
f |
[OCA]A:1360 |
x,y,z |
1_555 |
3 |
1 |
345 |
23.8 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.136 |
27 |
|
[ZN]B:1362 |
1 |
1 |
98 |
f |
[OCA]B:1360 |
x,y,z |
1_555 |
3 |
1 |
345 |
23.6 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.136 |
Average: |
23.7 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.136 |
20 |
28 |
|
[ZN]A:1362 |
1 |
1 |
98 |
f |
[NAJ]A:1361 |
x,y,z |
1_555 |
3 |
1 |
867 |
20.5 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.112 |
29 |
|
[ZN]B:1362 |
1 |
1 |
98 |
f |
[NAJ]B:1361 |
x,y,z |
1_555 |
3 |
1 |
871 |
20.0 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.112 |
Average: |
20.2 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.112 |
|