| ## |
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 |
124 |
32 |
15714 |
◊ |
B |
x,x-y-1,-z-1/6 |
12_544 |
125 |
32 |
15714 |
1125.6 |
2.8 |
0.771 |
18 |
16 |
0 |
0.000 |
2 |
|
A |
98 |
28 |
16786 |
◊ |
A |
x,x-y-1,-z-1/6 |
12_544 |
98 |
28 |
16786 |
908.4 |
-1.3 |
0.594 |
14 |
8 |
0 |
0.000 |
| Average: |
1017.0 |
0.8 |
0.682 |
16 |
12 |
0 |
0.000 |
| 2 |
3 |
|
B |
87 |
26 |
15714 |
◊ |
A |
x,y,z |
1_555 |
79 |
25 |
16786 |
805.4 |
-5.2 |
0.278 |
15 |
8 |
0 |
0.013 |
| 3 |
4 |
|
B |
62 |
15 |
15714 |
◊ |
A |
y,x-1,-z-1/3 |
7_544 |
55 |
16 |
16786 |
530.3 |
0.6 |
0.658 |
13 |
6 |
0 |
0.000 |
| 4 |
5 |
|
[0CP]B:1 |
23 |
1 |
521 |
f |
B |
x,y,z |
1_555 |
63 |
21 |
15714 |
382.5 |
4.9 |
0.300 |
2 |
0 |
0 |
0.000 |
6 |
|
[0CP]A:2 |
23 |
1 |
523 |
f |
A |
x,y,z |
1_555 |
62 |
21 |
16786 |
371.0 |
4.9 |
0.336 |
2 |
0 |
0 |
0.000 |
| Average: |
376.8 |
4.9 |
0.318 |
2 |
0 |
0 |
0.000 |
| 5 |
7 |
|
B |
42 |
13 |
15714 |
◊ |
A |
x-1,x-y-1,-z-1/6 |
12_444 |
39 |
10 |
16786 |
351.3 |
-2.0 |
0.410 |
2 |
2 |
0 |
0.000 |
| 6 |
8 |
|
B |
38 |
12 |
15714 |
◊ |
B |
y,x,-z-1/3 |
7_554 |
38 |
12 |
15714 |
338.6 |
-3.5 |
0.237 |
0 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[B3P]B:529 |
17 |
1 |
463 |
◊ |
[B3P]B:529 |
x,x-y-1,-z-1/6 |
12_544 |
17 |
1 |
463 |
172.4 |
4.8 |
0.179 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
B |
22 |
7 |
15714 |
◊ |
A |
x,x-y-1,-z-1/6 |
12_544 |
15 |
7 |
16786 |
168.8 |
2.1 |
0.822 |
4 |
4 |
0 |
0.000 |
| 9 |
11 |
|
B |
13 |
6 |
15714 |
◊ |
A |
x-y-1,x-1,z-1/6 |
6_444 |
15 |
8 |
16786 |
136.6 |
-0.2 |
0.471 |
2 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[B3P]B:529 |
13 |
1 |
463 |
f |
B |
x,x-y-1,-z-1/6 |
12_544 |
20 |
8 |
15714 |
128.9 |
-0.2 |
0.179 |
1 |
0 |
0 |
0.001 |
| 11 |
13 |
|
[B3P]B:529 |
11 |
1 |
463 |
◊ |
B |
x,y,z |
1_555 |
19 |
8 |
15714 |
128.3 |
2.8 |
0.486 |
2 |
0 |
0 |
0.000 |
| 12 |
14 |
|
A |
7 |
2 |
16786 |
◊ |
B |
x-y,x,z-1/6 |
6_554 |
10 |
4 |
15714 |
80.3 |
0.9 |
0.738 |
2 |
0 |
0 |
0.000 |
| 13 |
15 |
|
[MG]B:530 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
15714 |
57.0 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.016 |
16 |
|
[MG]A:529 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
16786 |
55.3 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.016 |
| Average: |
56.2 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.016 |
| 14 |
17 |
|
A |
7 |
1 |
16786 |
◊ |
A |
x,x-y,-z-1/6 |
12_554 |
7 |
1 |
16786 |
54.5 |
-0.1 |
0.570 |
0 |
0 |
0 |
0.000 |
| 15 |
18 |
|
[ZN]B:2 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
15714 |
47.0 |
-34.2 |
0.000 |
0 |
0 |
0 |
0.075 |
19 |
|
[ZN]A:1 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
16786 |
44.7 |
-32.3 |
0.000 |
0 |
0 |
0 |
0.075 |
| Average: |
45.9 |
-33.2 |
0.000 |
0 |
0 |
0 |
0.075 |
| 16 |
20 |
|
[MG]A:529 |
1 |
1 |
98 |
f |
[0CP]A:2 |
x,y,z |
1_555 |
3 |
1 |
523 |
19.3 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.004 |
21 |
|
[MG]B:530 |
1 |
1 |
98 |
f |
[0CP]B:1 |
x,y,z |
1_555 |
1 |
1 |
521 |
8.2 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.004 |
| Average: |
13.8 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.004 |
| 17 |
22 |
|
A |
2 |
1 |
16786 |
x |
A |
x-y,x,z-1/6 |
6_554 |
1 |
1 |
16786 |
17.1 |
0.7 |
0.775 |
0 |
0 |
0 |
0.000 |
| 18 |
23 |
|
[MG]A:529 |
1 |
1 |
98 |
f |
[ZN]A:1 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.4 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.018 |
| 19 |
24 |
|
[MG]B:530 |
1 |
1 |
98 |
f |
[ZN]B:2 |
x,y,z |
1_555 |
1 |
1 |
98 |
12.3 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.013 |
| 20 |
25 |
|
[0CP]B:1 |
3 |
1 |
521 |
f |
[ZN]B:2 |
x,y,z |
1_555 |
1 |
1 |
98 |
1.9 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.002 |
26 |
|
[0CP]A:2 |
2 |
1 |
523 |
f |
[ZN]A:1 |
x,y,z |
1_555 |
1 |
1 |
98 |
1.1 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.002 |
| Average: |
1.5 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.002 |
|