## |
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 |
370 |
99 |
20295 |
◊ |
A |
x,y,z |
1_555 |
368 |
96 |
19802 |
3556.8 |
-29.3 |
0.052 |
43 |
25 |
0 |
0.336 |
2 |
2 |
|
B |
67 |
24 |
20295 |
◊ |
B |
-x,-y+1,z |
2_565 |
68 |
24 |
20295 |
561.4 |
3.2 |
0.860 |
4 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
39 |
15 |
19802 |
◊ |
A |
-x,-y,z |
2_555 |
39 |
15 |
19802 |
388.1 |
-1.3 |
0.516 |
2 |
0 |
0 |
0.000 |
4 |
4 |
|
B |
29 |
10 |
20295 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
33 |
10 |
19802 |
303.9 |
-2.6 |
0.295 |
3 |
4 |
0 |
0.000 |
5 |
5 |
|
B |
27 |
9 |
20295 |
◊ |
A |
x,y,z-1 |
1_554 |
35 |
9 |
19802 |
302.9 |
1.3 |
0.722 |
6 |
8 |
0 |
0.000 |
6 |
6 |
|
A |
31 |
10 |
19802 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
34 |
11 |
20295 |
264.3 |
2.8 |
0.826 |
2 |
3 |
0 |
0.000 |
7 |
7 |
|
A |
29 |
11 |
19802 |
x |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
28 |
10 |
19802 |
232.5 |
4.5 |
0.911 |
4 |
5 |
0 |
0.000 |
8 |
8 |
|
B |
24 |
6 |
20295 |
x |
B |
-x-1/2,y-1/2,-z |
3_445 |
25 |
6 |
20295 |
209.8 |
-3.1 |
0.188 |
1 |
0 |
0 |
0.000 |
9 |
9 |
|
B |
25 |
12 |
20295 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
28 |
10 |
20295 |
178.6 |
2.8 |
0.871 |
4 |
4 |
0 |
0.000 |
10 |
10 |
|
[3HB]B:501 |
10 |
1 |
280 |
f |
B |
x,y,z |
1_555 |
34 |
13 |
20295 |
175.7 |
0.6 |
0.157 |
3 |
0 |
0 |
0.003 |
11 |
|
[3HB]A:501 |
10 |
1 |
279 |
f |
A |
x,y,z |
1_555 |
33 |
13 |
19802 |
174.9 |
1.6 |
0.232 |
3 |
0 |
0 |
0.003 |
Average: |
175.3 |
1.1 |
0.195 |
3 |
0 |
0 |
0.003 |
11 |
12 |
|
[PEG]A:502 |
7 |
1 |
259 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
19802 |
163.0 |
3.5 |
0.272 |
0 |
0 |
0 |
0.000 |
12 |
13 |
|
A |
15 |
5 |
19802 |
◊ |
B |
-x-1/2,y-1/2,-z |
3_445 |
21 |
6 |
20295 |
159.3 |
-0.5 |
0.507 |
0 |
1 |
0 |
0.000 |
13 |
14 |
|
[GOL]B:502 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
30 |
15 |
20295 |
150.8 |
-0.5 |
0.569 |
2 |
0 |
0 |
0.009 |
14 |
15 |
|
[EDO]B:504 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
20295 |
63.9 |
1.5 |
0.551 |
0 |
0 |
0 |
0.000 |
15 |
16 |
|
[EDO]B:503 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
20295 |
59.6 |
1.4 |
0.636 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[EDO]A:503 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
19802 |
54.9 |
1.3 |
0.646 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
B |
5 |
1 |
20295 |
◊ |
[EDO]A:503 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
184 |
45.9 |
1.1 |
0.798 |
1 |
0 |
0 |
0.000 |
18 |
19 |
|
B |
8 |
3 |
20295 |
f |
[ZN]A:505 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
98 |
37.3 |
-16.3 |
0.000 |
0 |
0 |
0 |
0.105 |
19 |
20 |
|
[ZN]B:505 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
20295 |
36.6 |
-28.1 |
0.000 |
0 |
0 |
0 |
0.357 |
21 |
|
[ZN]A:504 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
4 |
19802 |
36.6 |
-27.5 |
0.000 |
0 |
0 |
0 |
0.357 |
Average: |
36.6 |
-27.8 |
0.000 |
0 |
0 |
0 |
0.357 |
20 |
22 |
|
[GOL]B:502 |
4 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
19802 |
35.9 |
-0.2 |
0.370 |
0 |
0 |
0 |
0.001 |
21 |
23 |
|
B |
3 |
1 |
20295 |
◊ |
A |
-x,-y+1,z |
2_565 |
4 |
1 |
19802 |
34.9 |
0.8 |
0.855 |
0 |
0 |
0 |
0.000 |
22 |
24 |
|
[ZN]B:505 |
1 |
1 |
98 |
f |
[3HB]B:501 |
x,y,z |
1_555 |
3 |
1 |
280 |
28.3 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.154 |
25 |
|
[ZN]A:504 |
1 |
1 |
98 |
f |
[3HB]A:501 |
x,y,z |
1_555 |
3 |
1 |
279 |
28.2 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.154 |
Average: |
28.3 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.154 |
23 |
26 |
|
[MG]B:507 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
20295 |
20.6 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.014 |
24 |
27 |
|
[ZN]B:506 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
20295 |
20.4 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.054 |
25 |
28 |
|
A |
4 |
2 |
19802 |
f |
[EDO]B:503 |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
183 |
19.9 |
0.5 |
0.870 |
1 |
0 |
0 |
0.000 |
26 |
29 |
|
[MG]B:507 |
1 |
1 |
98 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
2 |
2 |
20295 |
17.6 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
30 |
|
[ZN]A:505 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
19802 |
15.9 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.000 |
28 |
31 |
|
[ZN]A:505 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
20295 |
15.2 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
29 |
32 |
|
[ZN]B:506 |
1 |
1 |
98 |
◊ |
B |
-x,-y+1,z |
2_565 |
2 |
1 |
20295 |
12.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.000 |
30 |
33 |
|
[EDO]A:503 |
1 |
1 |
184 |
f |
A |
-x,-y,z |
2_555 |
1 |
1 |
19802 |
6.7 |
0.2 |
0.899 |
0 |
0 |
0 |
0.000 |
|