## |
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 |
105 |
30 |
42447 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
4_645 |
104 |
34 |
42491 |
1001.3 |
0.5 |
0.873 |
12 |
7 |
0 |
0.000 |
2 |
2 |
|
B |
75 |
19 |
42447 |
◊ |
A |
-x,y-1/2,-z+1/2 |
4_545 |
84 |
22 |
42491 |
645.6 |
-1.1 |
0.835 |
5 |
4 |
0 |
0.000 |
3 |
3 |
|
[CZA]A:1005 |
23 |
1 |
503 |
f |
A |
x,y,z |
1_555 |
54 |
19 |
42491 |
360.9 |
2.4 |
0.453 |
0 |
0 |
0 |
0.000 |
4 |
|
[CZA]B:1005 |
23 |
1 |
503 |
f |
B |
x,y,z |
1_555 |
50 |
21 |
42447 |
349.3 |
2.7 |
0.459 |
1 |
0 |
0 |
0.000 |
Average: |
355.1 |
2.5 |
0.456 |
1 |
0 |
0 |
0.000 |
4 |
5 |
|
[ACP]A:1007 |
27 |
1 |
632 |
f |
A |
x,y,z |
1_555 |
52 |
21 |
42491 |
351.8 |
0.1 |
0.726 |
4 |
0 |
0 |
0.001 |
5 |
6 |
|
[ACP]B:1007 |
27 |
1 |
644 |
f |
B |
x,y,z |
1_555 |
49 |
21 |
42447 |
336.5 |
-1.6 |
0.524 |
5 |
0 |
0 |
0.003 |
6 |
7 |
|
A |
30 |
9 |
42491 |
x |
A |
-x+1,y-1/2,-z+1/2 |
4_645 |
41 |
16 |
42491 |
308.2 |
1.9 |
0.905 |
6 |
6 |
0 |
0.000 |
7 |
8 |
|
B |
38 |
12 |
42447 |
◊ |
A |
x-1/2,-y+1/2,-z |
3_455 |
38 |
12 |
42491 |
298.8 |
-1.6 |
0.619 |
2 |
2 |
0 |
0.000 |
8 |
9 |
|
B |
44 |
13 |
42447 |
◊ |
A |
x-1,y,z |
1_455 |
31 |
9 |
42491 |
295.3 |
-0.1 |
0.795 |
4 |
1 |
0 |
0.000 |
9 |
10 |
|
B |
30 |
11 |
42447 |
x |
B |
x-1/2,-y+1/2,-z |
3_455 |
30 |
12 |
42447 |
238.0 |
1.2 |
0.848 |
1 |
2 |
0 |
0.000 |
10 |
11 |
|
B |
27 |
8 |
42447 |
◊ |
A |
x,y,z |
1_555 |
21 |
5 |
42491 |
214.7 |
2.6 |
0.933 |
4 |
6 |
0 |
0.000 |
11 |
12 |
|
[K]B:1004 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
42447 |
125.6 |
-95.2 |
0.000 |
0 |
0 |
0 |
0.083 |
13 |
|
[K]A:1004 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
42491 |
119.5 |
-93.9 |
0.000 |
0 |
0 |
0 |
0.083 |
Average: |
122.6 |
-94.6 |
0.000 |
0 |
0 |
0 |
0.083 |
12 |
14 |
|
[ACT]B:3002 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
22 |
10 |
42447 |
114.7 |
-0.7 |
0.660 |
1 |
0 |
0 |
0.000 |
13 |
15 |
|
[ACT]A:3002 |
4 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
42491 |
109.5 |
-0.7 |
0.656 |
1 |
0 |
0 |
0.000 |
14 |
16 |
|
[ACT]B:3001 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
42447 |
100.9 |
-0.7 |
0.631 |
3 |
0 |
0 |
0.002 |
15 |
17 |
|
[ACT]A:3001 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
42491 |
100.5 |
-0.7 |
0.637 |
2 |
0 |
0 |
0.001 |
16 |
18 |
|
[MGF]A:1950 |
4 |
1 |
193 |
f |
A |
x,y,z |
1_555 |
11 |
9 |
42491 |
86.5 |
1.9 |
0.806 |
5 |
0 |
0 |
0.000 |
19 |
|
[MGF]B:1950 |
4 |
1 |
192 |
f |
B |
x,y,z |
1_555 |
12 |
9 |
42447 |
85.8 |
1.9 |
0.816 |
5 |
0 |
0 |
0.000 |
Average: |
86.1 |
1.9 |
0.811 |
5 |
0 |
0 |
0.000 |
17 |
20 |
|
[MN]B:1006 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
12 |
8 |
42447 |
64.3 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.003 |
21 |
|
[MN]A:1006 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
42491 |
58.9 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.003 |
Average: |
61.6 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.003 |
18 |
22 |
|
A |
7 |
2 |
42491 |
x |
A |
x-1/2,-y+3/2,-z |
3_465 |
9 |
4 |
42491 |
62.7 |
-0.2 |
0.641 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[ACP]A:1007 |
6 |
1 |
632 |
f |
[MN]A:1008 |
x,y,z |
1_555 |
1 |
1 |
123 |
54.3 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.004 |
20 |
24 |
|
[MN]A:1006 |
1 |
1 |
123 |
f |
[CZA]A:1005 |
x,y,z |
1_555 |
5 |
1 |
503 |
45.4 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.002 |
25 |
|
[MN]B:1006 |
1 |
1 |
123 |
f |
[CZA]B:1005 |
x,y,z |
1_555 |
5 |
1 |
503 |
43.0 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.002 |
Average: |
44.2 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.002 |
21 |
26 |
|
[MN]A:1008 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
42491 |
39.4 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.001 |
22 |
27 |
|
[MG]B:1002 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
42447 |
39.2 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.006 |
28 |
|
[MG]A:1002 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
42491 |
38.5 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.006 |
Average: |
38.9 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.006 |
23 |
29 |
|
[MGF]A:1950 |
1 |
1 |
193 |
f |
[MG]A:1002 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.4 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.002 |
30 |
|
[MGF]B:1950 |
1 |
1 |
192 |
f |
[MG]B:1002 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.002 |
Average: |
26.3 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.002 |
24 |
31 |
|
B |
3 |
3 |
42447 |
x |
B |
-x,y-1/2,-z+1/2 |
4_545 |
4 |
3 |
42447 |
23.4 |
-0.3 |
0.502 |
0 |
0 |
0 |
0.000 |
25 |
32 |
|
B |
2 |
2 |
42447 |
◊ |
A |
x,y-1,z |
1_545 |
3 |
2 |
42491 |
5.0 |
-0.1 |
0.598 |
0 |
0 |
0 |
0.000 |
|