## |
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 |
130 |
32 |
12938 |
◊ |
A |
x,y,z |
1_555 |
124 |
34 |
13031 |
1169.9 |
-3.4 |
0.822 |
21 |
12 |
0 |
0.035 |
2 |
2 |
|
A |
73 |
20 |
13031 |
◊ |
B |
x,y,z-1 |
1_554 |
74 |
23 |
12938 |
706.3 |
-15.3 |
0.020 |
2 |
0 |
0 |
0.368 |
3 |
3 |
|
A |
61 |
22 |
13031 |
x |
A |
-x+2,y-1/2,-z+1 |
2_746 |
69 |
18 |
13031 |
587.8 |
-4.7 |
0.521 |
5 |
4 |
0 |
0.000 |
4 |
4 |
|
[AMP]A:1001 |
23 |
1 |
478 |
f |
A |
x,y,z |
1_555 |
49 |
23 |
13031 |
326.7 |
-3.3 |
0.526 |
8 |
0 |
0 |
0.227 |
5 |
|
[AMP]B:1002 |
22 |
1 |
481 |
f |
B |
x,y,z |
1_555 |
42 |
19 |
12938 |
318.2 |
-0.4 |
0.709 |
6 |
0 |
0 |
0.227 |
Average: |
322.5 |
-1.9 |
0.617 |
7 |
0 |
0 |
0.227 |
5 |
6 |
|
A |
26 |
11 |
13031 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
25 |
10 |
13031 |
251.5 |
-3.3 |
0.298 |
2 |
0 |
0 |
0.000 |
6 |
7 |
|
B |
29 |
8 |
12938 |
◊ |
A |
-x+2,y-1/2,-z+2 |
2_747 |
22 |
8 |
13031 |
214.0 |
-3.2 |
0.283 |
3 |
0 |
0 |
0.000 |
7 |
8 |
|
B |
19 |
5 |
12938 |
◊ |
A |
x-1,y,z |
1_455 |
21 |
8 |
13031 |
197.9 |
-3.8 |
0.170 |
2 |
0 |
0 |
0.000 |
8 |
9 |
|
A |
23 |
7 |
13031 |
x |
A |
x-1,y,z |
1_455 |
18 |
7 |
13031 |
163.0 |
-2.5 |
0.327 |
1 |
0 |
0 |
0.000 |
9 |
10 |
|
B |
20 |
6 |
12938 |
x |
B |
-x+1,y-1/2,-z+2 |
2_647 |
17 |
5 |
12938 |
158.1 |
-2.2 |
0.371 |
1 |
0 |
0 |
0.000 |
10 |
11 |
|
[GOL]B:3001 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
24 |
13 |
12938 |
133.0 |
-0.8 |
0.527 |
4 |
0 |
0 |
0.114 |
12 |
|
[GOL]A:3003 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
26 |
14 |
13031 |
129.1 |
-0.7 |
0.620 |
4 |
0 |
0 |
0.114 |
Average: |
131.0 |
-0.7 |
0.574 |
4 |
0 |
0 |
0.114 |
11 |
13 |
|
[GOL]A:3002 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
24 |
11 |
13031 |
117.6 |
0.2 |
0.707 |
7 |
0 |
0 |
0.067 |
12 |
14 |
|
[EOH]B:4001 |
3 |
1 |
172 |
f |
B |
x,y,z |
1_555 |
21 |
7 |
12938 |
107.6 |
4.1 |
0.351 |
2 |
0 |
0 |
0.000 |
13 |
15 |
|
[EOH]A:4004 |
3 |
1 |
173 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
13031 |
100.7 |
3.4 |
0.499 |
1 |
0 |
0 |
0.000 |
14 |
16 |
|
[GOL]A:3004 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
13031 |
94.9 |
-0.1 |
0.643 |
3 |
0 |
0 |
0.034 |
15 |
17 |
|
[EOH]B:4003 |
3 |
1 |
172 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
12938 |
90.8 |
3.2 |
0.302 |
2 |
0 |
0 |
0.000 |
16 |
18 |
|
A |
20 |
8 |
13031 |
◊ |
[GOL]A:3004 |
-x+2,y-1/2,-z+1 |
2_746 |
5 |
1 |
216 |
89.2 |
-0.1 |
0.614 |
2 |
0 |
0 |
0.000 |
17 |
19 |
|
[SO4]A:5001 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
13031 |
84.2 |
-11.8 |
0.944 |
4 |
0 |
0 |
0.309 |
18 |
20 |
|
[GOL]A:3006 |
5 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
13031 |
80.6 |
-0.1 |
0.589 |
3 |
0 |
0 |
0.003 |
19 |
21 |
|
[EOH]B:4002 |
3 |
1 |
172 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
12938 |
74.9 |
1.6 |
0.104 |
2 |
0 |
0 |
0.000 |
20 |
22 |
|
[GOL]A:3006 |
4 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
12938 |
73.5 |
-0.4 |
0.535 |
3 |
0 |
0 |
0.058 |
21 |
23 |
|
[EOH]A:4005 |
3 |
1 |
172 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
12938 |
64.7 |
1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
22 |
24 |
|
A |
11 |
5 |
13031 |
◊ |
[EOH]B:4002 |
x,y,z-1 |
1_554 |
3 |
1 |
172 |
61.1 |
1.3 |
0.000 |
1 |
0 |
0 |
0.000 |
23 |
25 |
|
[EOH]A:4005 |
3 |
1 |
172 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
13031 |
60.9 |
1.6 |
0.000 |
1 |
0 |
0 |
0.000 |
24 |
26 |
|
[GOL]A:3002 |
5 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
12938 |
47.6 |
-0.4 |
0.527 |
1 |
0 |
0 |
0.002 |
25 |
27 |
|
B |
7 |
3 |
12938 |
x |
B |
-x+2,y-1/2,-z+2 |
2_747 |
6 |
3 |
12938 |
44.7 |
-1.4 |
0.251 |
0 |
0 |
0 |
0.000 |
26 |
28 |
|
B |
8 |
4 |
12938 |
◊ |
A |
-x+2,y-1/2,-z+1 |
2_746 |
5 |
3 |
13031 |
44.4 |
-0.6 |
0.365 |
0 |
0 |
0 |
0.000 |
27 |
29 |
|
[GOL]B:3001 |
3 |
1 |
218 |
f |
[AMP]B:1002 |
x,y,z |
1_555 |
6 |
1 |
481 |
42.5 |
-0.6 |
0.488 |
1 |
0 |
0 |
0.043 |
30 |
|
[GOL]A:3003 |
3 |
1 |
219 |
f |
[AMP]A:1001 |
x,y,z |
1_555 |
6 |
1 |
478 |
40.3 |
-0.4 |
0.499 |
1 |
0 |
0 |
0.043 |
Average: |
41.4 |
-0.5 |
0.494 |
1 |
0 |
0 |
0.043 |
28 |
31 |
|
B |
8 |
3 |
12938 |
x |
B |
x-1,y,z |
1_455 |
5 |
4 |
12938 |
40.0 |
-0.2 |
0.576 |
0 |
0 |
0 |
0.000 |
29 |
32 |
|
[EOH]A:4004 |
2 |
1 |
173 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
12938 |
35.3 |
1.6 |
0.311 |
0 |
0 |
0 |
0.000 |
30 |
33 |
|
[EOH]B:4003 |
3 |
1 |
172 |
f |
A |
-x+2,y-1/2,-z+2 |
2_747 |
4 |
2 |
13031 |
34.7 |
1.3 |
0.885 |
0 |
0 |
0 |
0.000 |
31 |
34 |
|
B |
1 |
1 |
12938 |
◊ |
A |
-x+1,y-1/2,-z+2 |
2_647 |
1 |
1 |
13031 |
8.5 |
-0.0 |
0.444 |
0 |
0 |
0 |
0.000 |
32 |
35 |
|
[EOH]B:4001 |
1 |
1 |
172 |
f |
[AMP]B:1002 |
x,y,z |
1_555 |
1 |
1 |
481 |
1.8 |
-0.0 |
0.522 |
0 |
0 |
0 |
0.001 |
33 |
36 |
|
[SO4]A:5001 |
1 |
1 |
185 |
◊ |
A |
x-1,y,z |
1_455 |
1 |
1 |
13031 |
0.4 |
-0.0 |
0.753 |
0 |
0 |
0 |
0.000 |
|