## |
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 |
82 |
27 |
6404 |
x |
B |
-y,x,z |
2_555 |
80 |
25 |
6404 |
859.2 |
-15.7 |
0.627 |
1 |
6 |
0 |
0.631 |
2 |
|
A |
81 |
26 |
6120 |
x |
A |
-y,x,z |
2_555 |
80 |
26 |
6120 |
790.1 |
-15.2 |
0.660 |
2 |
5 |
0 |
0.631 |
Average: |
824.6 |
-15.4 |
0.644 |
2 |
6 |
0 |
0.631 |
2 |
3 |
|
B |
22 |
9 |
6404 |
◊ |
A |
-x-1/2,-y-1/2,z-1/2 |
7_444 |
27 |
10 |
6120 |
298.3 |
-7.0 |
0.306 |
0 |
0 |
0 |
0.196 |
3 |
4 |
|
B |
30 |
7 |
6404 |
◊ |
A |
-y-1/2,x+1/2,z-1/2 |
6_454 |
28 |
7 |
6120 |
257.1 |
-2.2 |
0.901 |
1 |
2 |
0 |
0.000 |
4 |
5 |
|
B |
25 |
7 |
6404 |
◊ |
A |
-y-1/2,x-1/2,z-1/2 |
6_444 |
20 |
7 |
6120 |
199.5 |
-1.6 |
0.761 |
0 |
0 |
0 |
0.000 |
5 |
6 |
|
[MPD]A:206 |
7 |
1 |
276 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
6120 |
122.1 |
-8.4 |
0.727 |
0 |
0 |
0 |
0.236 |
6 |
7 |
|
[MPD]A:205 |
7 |
1 |
271 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
6120 |
112.8 |
-7.8 |
0.787 |
0 |
0 |
0 |
0.218 |
7 |
8 |
|
[MPD]B:203 |
6 |
1 |
278 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
6404 |
110.6 |
-7.2 |
0.848 |
0 |
0 |
0 |
0.267 |
8 |
9 |
|
[MPD]B:203 |
6 |
1 |
278 |
f |
B |
-y,x,z |
2_555 |
14 |
5 |
6404 |
110.3 |
-7.4 |
0.803 |
0 |
0 |
0 |
0.276 |
9 |
10 |
|
B |
11 |
4 |
6404 |
◊ |
[MPD]A:205 |
-x-1/2,-y-1/2,z-1/2 |
7_444 |
6 |
1 |
271 |
105.4 |
-6.9 |
0.810 |
0 |
0 |
0 |
0.195 |
10 |
11 |
|
B |
8 |
4 |
6404 |
◊ |
A |
-x,-y,z-1 |
3_554 |
9 |
4 |
6120 |
102.3 |
-1.6 |
0.570 |
1 |
0 |
0 |
0.000 |
11 |
12 |
|
[HEX]B:204 |
6 |
1 |
268 |
◊ |
B |
-y,x,z |
2_555 |
10 |
7 |
6404 |
100.6 |
2.6 |
0.625 |
0 |
0 |
0 |
0.000 |
12 |
13 |
|
[HEX]A:207 |
6 |
1 |
268 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
6120 |
98.0 |
3.9 |
0.972 |
0 |
0 |
0 |
0.000 |
13 |
14 |
|
[HEX]B:204 |
6 |
1 |
268 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
6404 |
90.2 |
1.9 |
0.713 |
0 |
0 |
0 |
0.000 |
14 |
15 |
|
A |
13 |
4 |
6120 |
◊ |
B |
-y,x,z+1 |
2_556 |
7 |
2 |
6404 |
82.2 |
0.1 |
0.892 |
0 |
1 |
0 |
0.000 |
15 |
16 |
|
[MPD]A:206 |
6 |
1 |
276 |
◊ |
A |
-y,x,z |
2_555 |
9 |
3 |
6120 |
78.4 |
-5.3 |
0.679 |
0 |
0 |
0 |
0.140 |
16 |
17 |
|
[CS]B:201 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
9 |
4 |
6404 |
62.3 |
-16.0 |
0.000 |
0 |
0 |
0 |
0.257 |
18 |
|
[CS]A:202 |
1 |
1 |
216 |
x |
A |
x,y,z |
1_555 |
10 |
4 |
6120 |
61.1 |
-16.5 |
0.000 |
0 |
0 |
0 |
0.257 |
Average: |
61.7 |
-16.3 |
0.000 |
0 |
0 |
0 |
0.257 |
17 |
19 |
|
[CS]B:202 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
7 |
4 |
6404 |
61.4 |
-15.0 |
0.000 |
0 |
0 |
0 |
0.240 |
20 |
|
[CS]A:203 |
1 |
1 |
216 |
x |
A |
x,y,z |
1_555 |
7 |
4 |
6120 |
57.7 |
-15.1 |
0.000 |
0 |
0 |
0 |
0.240 |
Average: |
59.6 |
-15.0 |
0.000 |
0 |
0 |
0 |
0.240 |
18 |
21 |
|
B |
6 |
1 |
6404 |
◊ |
A |
x-1/2,y+1/2,z-1/2 |
5_454 |
6 |
2 |
6120 |
52.1 |
1.0 |
0.918 |
0 |
0 |
0 |
0.000 |
19 |
22 |
|
[CS]A:201 |
1 |
1 |
216 |
x |
A |
x,y,z |
1_555 |
8 |
3 |
6120 |
51.4 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.148 |
20 |
23 |
|
[CS]B:202 |
1 |
1 |
216 |
f |
[CS]B:201 |
x,y,z |
1_555 |
1 |
1 |
216 |
44.6 |
-17.8 |
0.000 |
0 |
0 |
0 |
0.100 |
21 |
24 |
|
[CS]A:203 |
1 |
1 |
216 |
f |
[CS]A:202 |
x,y,z |
1_555 |
1 |
1 |
216 |
44.6 |
-17.8 |
0.000 |
0 |
0 |
0 |
0.029 |
22 |
25 |
|
[CS]A:201 |
1 |
1 |
216 |
fx |
[CS]A:201 |
-y,x,z |
2_555 |
1 |
1 |
216 |
41.6 |
-16.7 |
0.000 |
0 |
0 |
0 |
0.162 |
23 |
26 |
|
[HEX]A:207 |
3 |
1 |
268 |
f |
[CS]A:201 |
x,y,z |
1_555 |
1 |
1 |
216 |
40.0 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.028 |
24 |
27 |
|
[CS]A:201 |
1 |
1 |
216 |
f |
[HEX]A:207 |
-y,x,z |
2_555 |
5 |
1 |
268 |
35.4 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.029 |
25 |
28 |
|
[NA]A:204 |
1 |
1 |
125 |
f |
[CS]A:202 |
x,y,z |
1_555 |
1 |
1 |
216 |
35.2 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.016 |
26 |
29 |
|
[NA]A:204 |
1 |
1 |
125 |
x |
A |
x,y,z |
1_555 |
5 |
2 |
6120 |
34.9 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.032 |
27 |
30 |
|
[CS]A:203 |
1 |
1 |
216 |
fx |
[CS]A:201 |
x,y,z |
1_555 |
1 |
1 |
216 |
32.0 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.083 |
28 |
31 |
|
[HEX]A:207 |
1 |
1 |
268 |
fx |
[HEX]A:207 |
-y,x,z |
2_555 |
3 |
1 |
268 |
22.4 |
1.5 |
1.000 |
0 |
0 |
0 |
0.000 |
29 |
32 |
|
A |
4 |
2 |
6120 |
x |
[CS]A:201 |
-y,x,z |
2_555 |
1 |
1 |
216 |
16.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.038 |
30 |
33 |
|
[HEX]A:207 |
1 |
1 |
268 |
f |
[CS]A:201 |
-y,x,z |
2_555 |
1 |
1 |
216 |
15.2 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.011 |
31 |
34 |
|
A |
5 |
3 |
6120 |
◊ |
A |
-x,-y,z |
3_555 |
5 |
3 |
6120 |
13.1 |
0.3 |
0.895 |
0 |
0 |
0 |
0.000 |
35 |
|
B |
5 |
3 |
6404 |
◊ |
B |
-x,-y,z |
3_555 |
5 |
3 |
6404 |
10.4 |
0.2 |
0.874 |
0 |
0 |
0 |
0.000 |
Average: |
11.7 |
0.2 |
0.885 |
0 |
0 |
0 |
0.000 |
32 |
36 |
|
[HEX]A:207 |
2 |
1 |
268 |
f |
[CS]A:201 |
-x,-y,z |
3_555 |
1 |
1 |
216 |
8.8 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.007 |
33 |
37 |
|
B |
1 |
1 |
6404 |
◊ |
A |
-x+1/2,-y-1/2,z-1/2 |
7_544 |
1 |
1 |
6120 |
3.1 |
0.1 |
0.856 |
0 |
0 |
0 |
0.000 |
34 |
38 |
|
A |
1 |
1 |
6120 |
◊ |
[HEX]A:207 |
-y,x,z |
2_555 |
2 |
1 |
268 |
2.1 |
0.0 |
0.763 |
0 |
0 |
0 |
0.000 |
35 |
39 |
|
B |
1 |
1 |
6404 |
x |
B |
-y-1/2,x+1/2,z-1/2 |
6_454 |
1 |
1 |
6404 |
1.3 |
-0.0 |
0.702 |
0 |
0 |
0 |
0.000 |
36 |
40 |
|
A |
1 |
1 |
6120 |
x |
A |
-x+1/2,-y-1/2,z-1/2 |
7_544 |
1 |
1 |
6120 |
0.9 |
0.0 |
0.816 |
0 |
0 |
0 |
0.000 |
|