| ## |
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 |
136 |
34 |
10828 |
◊ |
A |
x,y,z |
1_555 |
130 |
33 |
11766 |
1332.5 |
-24.5 |
0.019 |
12 |
0 |
0 |
0.285 |
| 2 |
2 |
|
A |
47 |
15 |
11766 |
◊ |
B |
x-1,y,z |
1_455 |
50 |
13 |
10828 |
405.5 |
-3.0 |
0.427 |
2 |
0 |
0 |
0.000 |
| 3 |
3 |
|
A |
33 |
7 |
11766 |
x |
A |
-x-1,y-1/2,-z+2 |
2_447 |
27 |
12 |
11766 |
251.9 |
-1.0 |
0.607 |
4 |
0 |
0 |
0.000 |
| 4 |
4 |
|
B |
18 |
5 |
10828 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
19 |
5 |
11766 |
144.0 |
-1.6 |
0.496 |
1 |
0 |
0 |
0.000 |
| 5 |
5 |
|
[IOD]B:308 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
10828 |
83.7 |
-0.1 |
0.799 |
0 |
0 |
0 |
0.002 |
6 |
|
[IOD]A:305 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
11766 |
81.7 |
-0.1 |
0.728 |
0 |
0 |
0 |
0.002 |
| Average: |
82.7 |
-0.1 |
0.763 |
0 |
0 |
0 |
0.002 |
| 6 |
7 |
|
[IOD]A:306 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
11766 |
81.0 |
0.7 |
0.901 |
0 |
0 |
0 |
0.000 |
8 |
|
[IOD]B:319 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
10828 |
77.2 |
0.2 |
0.849 |
0 |
0 |
0 |
0.000 |
| Average: |
79.1 |
0.4 |
0.875 |
0 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[IOD]A:308 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
11766 |
80.9 |
0.1 |
0.795 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
B |
8 |
3 |
10828 |
x |
B |
x-1,y,z |
1_455 |
9 |
2 |
10828 |
79.2 |
-0.6 |
0.561 |
1 |
0 |
0 |
0.000 |
| 9 |
11 |
|
[IOD]A:307 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
11766 |
78.5 |
-0.1 |
0.705 |
0 |
0 |
0 |
0.001 |
| 10 |
12 |
|
[IOD]B:307 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
10828 |
78.1 |
-0.2 |
0.775 |
0 |
0 |
0 |
0.004 |
13 |
|
[IOD]A:303 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
11766 |
77.8 |
-0.2 |
0.737 |
0 |
0 |
0 |
0.004 |
| Average: |
77.9 |
-0.2 |
0.756 |
0 |
0 |
0 |
0.004 |
| 11 |
14 |
|
[IOD]B:318 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
10828 |
77.6 |
-0.0 |
0.805 |
0 |
0 |
0 |
0.001 |
15 |
|
[IOD]A:304 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
11766 |
75.3 |
-0.1 |
0.722 |
0 |
0 |
0 |
0.001 |
| Average: |
76.5 |
-0.1 |
0.764 |
0 |
0 |
0 |
0.001 |
| 12 |
16 |
|
[IOD]A:311 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
11766 |
77.3 |
-0.2 |
0.728 |
0 |
0 |
0 |
0.002 |
| 13 |
17 |
|
[IOD]B:303 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
10828 |
77.0 |
-0.6 |
0.652 |
0 |
0 |
0 |
0.011 |
18 |
|
[IOD]A:316 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
11766 |
76.7 |
-0.5 |
0.598 |
0 |
0 |
0 |
0.011 |
| Average: |
76.9 |
-0.6 |
0.625 |
0 |
0 |
0 |
0.011 |
| 14 |
19 |
|
[IOD]A:309 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
11766 |
74.5 |
0.3 |
0.845 |
0 |
0 |
0 |
0.000 |
| 15 |
20 |
|
[IOD]A:315 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
11766 |
74.4 |
-0.6 |
0.539 |
0 |
0 |
0 |
0.006 |
| 16 |
21 |
|
[IOD]B:311 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
13 |
6 |
10828 |
71.4 |
-0.1 |
0.784 |
0 |
0 |
0 |
0.001 |
| 17 |
22 |
|
[IOD]A:312 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
11766 |
70.6 |
-0.2 |
0.717 |
0 |
0 |
0 |
0.007 |
23 |
|
[IOD]B:315 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
10828 |
65.4 |
-0.5 |
0.730 |
0 |
0 |
0 |
0.007 |
| Average: |
68.0 |
-0.3 |
0.723 |
0 |
0 |
0 |
0.007 |
| 18 |
24 |
|
[IOD]A:314 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
11766 |
69.2 |
0.3 |
0.851 |
0 |
0 |
0 |
0.000 |
25 |
|
[IOD]B:312 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
10828 |
68.3 |
-0.2 |
0.750 |
0 |
0 |
0 |
0.000 |
| Average: |
68.7 |
0.1 |
0.801 |
0 |
0 |
0 |
0.001 |
| 19 |
26 |
|
[IOD]A:317 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
11766 |
68.1 |
-0.3 |
0.666 |
0 |
0 |
0 |
0.006 |
27 |
|
[IOD]B:305 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
10828 |
67.5 |
-0.3 |
0.737 |
0 |
0 |
0 |
0.006 |
| Average: |
67.8 |
-0.3 |
0.702 |
0 |
0 |
0 |
0.006 |
| 20 |
28 |
|
[IOD]B:306 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
10828 |
67.3 |
-0.2 |
0.760 |
0 |
0 |
0 |
0.001 |
| 21 |
29 |
|
[IOD]A:310 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
11766 |
66.6 |
-0.1 |
0.765 |
0 |
0 |
0 |
0.000 |
| 22 |
30 |
|
[IOD]A:318 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
11766 |
66.3 |
0.1 |
0.810 |
0 |
0 |
0 |
0.000 |
| 23 |
31 |
|
[IOD]B:317 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
10828 |
65.2 |
-0.0 |
0.791 |
0 |
0 |
0 |
0.000 |
| 24 |
32 |
|
[IOD]B:304 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
10828 |
64.4 |
-0.3 |
0.761 |
0 |
0 |
0 |
0.003 |
| 25 |
33 |
|
[IOD]A:313 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
11766 |
64.4 |
-0.4 |
0.635 |
0 |
0 |
0 |
0.007 |
34 |
|
[IOD]B:316 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
10828 |
62.6 |
-0.4 |
0.720 |
0 |
0 |
0 |
0.007 |
| Average: |
63.5 |
-0.4 |
0.678 |
0 |
0 |
0 |
0.007 |
| 26 |
35 |
|
[IOD]B:314 |
1 |
1 |
144 |
f |
A |
-x,y-1/2,-z+1 |
2_546 |
8 |
4 |
11766 |
62.8 |
-0.5 |
0.548 |
0 |
0 |
0 |
0.005 |
| 27 |
36 |
|
[IOD]B:310 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
11766 |
61.8 |
0.5 |
0.899 |
0 |
0 |
0 |
0.000 |
| 28 |
37 |
|
[IOD]B:313 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
10828 |
60.8 |
-0.1 |
0.800 |
0 |
0 |
0 |
0.001 |
| 29 |
38 |
|
[IOD]B:309 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
10828 |
59.3 |
-0.5 |
0.679 |
0 |
0 |
0 |
0.004 |
| 30 |
39 |
|
[ZN]A:319 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
11766 |
51.8 |
-38.2 |
0.000 |
0 |
0 |
0 |
0.656 |
40 |
|
[ZN]B:320 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
10828 |
49.6 |
-30.5 |
0.000 |
0 |
0 |
0 |
0.656 |
| Average: |
50.7 |
-34.3 |
0.000 |
0 |
0 |
0 |
0.656 |
| 31 |
41 |
|
A |
7 |
4 |
11766 |
◊ |
[IOD]B:313 |
x-1,y,z |
1_455 |
1 |
1 |
144 |
49.4 |
-0.1 |
0.744 |
0 |
0 |
0 |
0.000 |
| 32 |
42 |
|
[IOD]B:314 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
10828 |
48.9 |
-0.3 |
0.696 |
0 |
0 |
0 |
0.000 |
| 33 |
43 |
|
[IOD]B:310 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
10828 |
46.9 |
-0.2 |
0.771 |
0 |
0 |
0 |
0.002 |
| 34 |
44 |
|
A |
7 |
2 |
11766 |
◊ |
[IOD]B:309 |
x-1,y,z |
1_455 |
1 |
1 |
144 |
39.1 |
-0.4 |
0.585 |
0 |
0 |
0 |
0.000 |
| 35 |
45 |
|
[IOD]B:317 |
1 |
1 |
144 |
f |
A |
-x,y-1/2,-z+1 |
2_546 |
5 |
3 |
11766 |
37.9 |
-0.4 |
0.544 |
0 |
0 |
0 |
0.004 |
| 36 |
46 |
|
[IOD]A:307 |
1 |
1 |
144 |
◊ |
[IOD]A:306 |
x,y,z |
1_555 |
1 |
1 |
144 |
31.2 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
| 37 |
47 |
|
[IOD]B:311 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
11766 |
29.9 |
-0.4 |
0.448 |
0 |
0 |
0 |
0.003 |
| 38 |
48 |
|
A |
6 |
3 |
11766 |
◊ |
B |
x-1,y,z+1 |
1_456 |
4 |
3 |
10828 |
26.4 |
-0.1 |
0.502 |
0 |
0 |
0 |
0.000 |
| 39 |
49 |
|
[IOD]B:307 |
1 |
1 |
144 |
f |
[IOD]B:306 |
x,y,z |
1_555 |
1 |
1 |
144 |
15.5 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
| 40 |
50 |
|
A |
2 |
1 |
11766 |
◊ |
[IOD]B:309 |
-x,y-1/2,-z+2 |
2_547 |
1 |
1 |
144 |
13.2 |
0.5 |
0.960 |
0 |
0 |
0 |
0.000 |
| 41 |
51 |
|
[IOD]A:312 |
1 |
1 |
144 |
f |
[IOD]A:311 |
x,y,z |
1_555 |
1 |
1 |
144 |
13.1 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
| 42 |
52 |
|
B |
1 |
1 |
10828 |
◊ |
[IOD]B:311 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
144 |
7.0 |
0.1 |
0.924 |
0 |
0 |
0 |
0.000 |
| 43 |
53 |
|
[IOD]B:304 |
1 |
1 |
144 |
f |
[IOD]B:303 |
x,y,z |
1_555 |
1 |
1 |
144 |
6.4 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
| 44 |
54 |
|
[IOD]B:306 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
11766 |
2.8 |
-0.0 |
0.633 |
0 |
0 |
0 |
0.000 |
| 45 |
55 |
|
[IOD]A:310 |
1 |
1 |
144 |
f |
[IOD]A:309 |
x,y,z |
1_555 |
1 |
1 |
144 |
2.4 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
| 46 |
56 |
|
A |
1 |
1 |
11766 |
f |
[IOD]B:319 |
x-1,y,z |
1_455 |
1 |
1 |
144 |
1.4 |
0.0 |
0.844 |
0 |
0 |
0 |
0.000 |
| 47 |
57 |
|
A |
1 |
1 |
11766 |
◊ |
B |
-x,y-1/2,-z+2 |
2_547 |
1 |
1 |
10828 |
1.1 |
0.1 |
0.746 |
0 |
0 |
0 |
0.000 |
|