## |
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 |
|
A |
95 |
32 |
9417 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
83 |
19 |
9961 |
856.9 |
-11.7 |
0.060 |
3 |
4 |
0 |
0.000 |
2 |
2 |
|
[COA]B:201 |
44 |
1 |
948 |
f |
B |
x,y,z |
1_555 |
82 |
25 |
9961 |
541.6 |
2.1 |
0.576 |
13 |
0 |
0 |
0.027 |
3 |
|
[COA]A:201 |
45 |
1 |
951 |
f |
A |
x,y,z |
1_555 |
80 |
25 |
9417 |
534.2 |
2.3 |
0.542 |
13 |
0 |
0 |
0.027 |
Average: |
537.9 |
2.2 |
0.559 |
13 |
0 |
0 |
0.027 |
3 |
4 |
|
B |
32 |
11 |
9961 |
x |
B |
x-1,y,z |
1_455 |
34 |
13 |
9961 |
320.3 |
1.8 |
0.785 |
5 |
3 |
0 |
0.000 |
5 |
|
A |
32 |
13 |
9417 |
x |
A |
x-1,y,z |
1_455 |
31 |
10 |
9417 |
292.4 |
1.5 |
0.743 |
4 |
3 |
0 |
0.000 |
Average: |
306.4 |
1.6 |
0.764 |
5 |
3 |
0 |
0.000 |
4 |
6 |
|
A |
29 |
8 |
9417 |
◊ |
B |
x,y-1,z |
1_545 |
30 |
9 |
9961 |
262.8 |
0.5 |
0.667 |
4 |
6 |
0 |
0.000 |
7 |
|
B |
28 |
7 |
9961 |
◊ |
A |
x,y,z |
1_555 |
31 |
9 |
9417 |
259.5 |
0.4 |
0.651 |
3 |
6 |
0 |
0.000 |
Average: |
261.1 |
0.5 |
0.659 |
4 |
6 |
0 |
0.000 |
5 |
8 |
|
B |
20 |
8 |
9961 |
x |
B |
x,y-1,z |
1_545 |
25 |
9 |
9961 |
163.0 |
-1.2 |
0.463 |
1 |
0 |
0 |
0.000 |
9 |
|
A |
21 |
9 |
9417 |
x |
A |
x,y-1,z |
1_545 |
24 |
9 |
9417 |
162.6 |
-1.2 |
0.431 |
1 |
0 |
0 |
0.000 |
Average: |
162.8 |
-1.2 |
0.447 |
1 |
0 |
0 |
0.000 |
6 |
10 |
|
A |
14 |
4 |
9417 |
◊ |
B |
x-1,y-1,z |
1_445 |
20 |
7 |
9961 |
134.8 |
-1.9 |
0.298 |
2 |
0 |
0 |
0.000 |
11 |
|
A |
20 |
7 |
9417 |
◊ |
B |
x-1,y,z |
1_455 |
13 |
4 |
9961 |
132.7 |
-1.5 |
0.339 |
1 |
0 |
0 |
0.000 |
Average: |
133.7 |
-1.7 |
0.319 |
2 |
0 |
0 |
0.000 |
7 |
12 |
|
A |
17 |
7 |
9417 |
◊ |
[COA]B:201 |
x,y-1,z |
1_545 |
14 |
1 |
948 |
124.2 |
1.7 |
0.652 |
0 |
0 |
0 |
0.000 |
13 |
|
[COA]A:201 |
13 |
1 |
951 |
◊ |
B |
x,y,z |
1_555 |
19 |
7 |
9961 |
123.3 |
1.7 |
0.664 |
0 |
0 |
0 |
0.000 |
Average: |
123.8 |
1.7 |
0.658 |
0 |
0 |
0 |
0.000 |
8 |
14 |
|
[EDO]B:204 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
9961 |
108.9 |
1.9 |
0.325 |
0 |
0 |
0 |
0.000 |
9 |
15 |
|
[EDO]A:205 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
9417 |
107.4 |
3.6 |
0.536 |
3 |
0 |
0 |
0.000 |
10 |
16 |
|
[EDO]A:202 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
9417 |
99.6 |
3.6 |
0.484 |
1 |
0 |
0 |
0.000 |
11 |
17 |
|
[EDO]B:205 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
9961 |
96.0 |
3.4 |
0.494 |
1 |
0 |
0 |
0.000 |
12 |
18 |
|
[EDO]A:206 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
15 |
7 |
9417 |
89.2 |
2.5 |
0.379 |
3 |
0 |
0 |
0.000 |
13 |
19 |
|
[EDO]A:207 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
9417 |
79.2 |
2.1 |
0.455 |
2 |
0 |
0 |
0.000 |
14 |
20 |
|
[EDO]A:208 |
3 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
9961 |
66.0 |
1.3 |
0.207 |
1 |
0 |
0 |
0.000 |
15 |
21 |
|
[EDO]A:208 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
9417 |
65.2 |
1.4 |
0.629 |
0 |
0 |
0 |
0.000 |
16 |
22 |
|
[UNX]B:202 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
16 |
10 |
9961 |
55.2 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.022 |
23 |
|
[UNX]A:204 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
15 |
10 |
9417 |
46.8 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.022 |
Average: |
51.0 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.022 |
17 |
24 |
|
[UNX]B:203 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
9961 |
52.4 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.028 |
25 |
|
[UNX]A:203 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
9417 |
49.2 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.028 |
Average: |
50.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.028 |
18 |
26 |
|
[UNX]A:210 |
1 |
1 |
129 |
f |
B |
x-1,y,z |
1_455 |
13 |
4 |
9961 |
49.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.011 |
27 |
|
[UNX]A:209 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
9417 |
37.1 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.011 |
Average: |
43.4 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.011 |
19 |
28 |
|
[COA]B:201 |
5 |
1 |
948 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
9417 |
47.6 |
-1.3 |
0.325 |
0 |
0 |
0 |
0.000 |
29 |
|
[COA]A:201 |
6 |
1 |
951 |
◊ |
B |
x,y-1,z |
1_545 |
5 |
2 |
9961 |
47.4 |
-1.3 |
0.340 |
0 |
0 |
0 |
0.000 |
Average: |
47.5 |
-1.3 |
0.332 |
0 |
0 |
0 |
0.000 |
20 |
30 |
|
[EDO]A:205 |
4 |
1 |
184 |
f |
B |
x-1,y-1,z-1 |
1_444 |
9 |
3 |
9961 |
46.7 |
1.1 |
0.757 |
1 |
0 |
0 |
0.000 |
21 |
31 |
|
A |
10 |
4 |
9417 |
◊ |
B |
x-1,y,z-1 |
1_454 |
5 |
2 |
9961 |
40.0 |
0.5 |
0.708 |
0 |
1 |
0 |
0.000 |
22 |
32 |
|
A |
2 |
1 |
9417 |
◊ |
[COA]A:201 |
x-1,y,z |
1_455 |
4 |
1 |
951 |
38.2 |
-1.0 |
0.408 |
2 |
0 |
0 |
0.000 |
33 |
|
[COA]B:201 |
4 |
1 |
948 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
9961 |
37.3 |
-1.0 |
0.403 |
2 |
0 |
0 |
0.000 |
Average: |
37.8 |
-1.0 |
0.405 |
2 |
0 |
0 |
0.000 |
23 |
34 |
|
[UNX]A:212 |
1 |
1 |
129 |
f |
B |
x-1,y,z |
1_455 |
4 |
2 |
9961 |
35.1 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.010 |
35 |
|
[UNX]A:211 |
1 |
1 |
129 |
f |
B |
x-1,y,z |
1_455 |
5 |
2 |
9961 |
26.8 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.010 |
Average: |
31.0 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.010 |
24 |
36 |
|
[UNX]A:211 |
1 |
1 |
129 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
9417 |
34.3 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
37 |
|
[UNX]A:209 |
1 |
1 |
129 |
◊ |
B |
x-1,y-1,z |
1_445 |
5 |
2 |
9961 |
29.2 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
38 |
|
[UNX]A:212 |
1 |
1 |
129 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
9417 |
25.8 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
39 |
|
[UNX]A:210 |
1 |
1 |
129 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
9417 |
6.8 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
24.0 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
40 |
|
[UNX]B:202 |
1 |
1 |
129 |
f |
[COA]B:201 |
x,y,z |
1_555 |
4 |
1 |
948 |
33.9 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.027 |
41 |
|
[UNX]A:204 |
1 |
1 |
129 |
f |
[COA]A:201 |
x,y,z |
1_555 |
4 |
1 |
951 |
31.0 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.027 |
42 |
|
[UNX]B:203 |
1 |
1 |
129 |
f |
[COA]B:201 |
x,y,z |
1_555 |
3 |
1 |
948 |
28.8 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.027 |
43 |
|
[UNX]A:203 |
1 |
1 |
129 |
f |
[COA]A:201 |
x,y,z |
1_555 |
3 |
1 |
951 |
27.6 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.027 |
Average: |
30.3 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.027 |
26 |
44 |
|
[EDO]A:207 |
3 |
1 |
184 |
f |
[COA]A:201 |
x,y,z |
1_555 |
6 |
1 |
951 |
33.2 |
1.3 |
0.734 |
1 |
0 |
0 |
0.000 |
27 |
45 |
|
[UNX]A:212 |
1 |
1 |
129 |
f |
[UNX]A:211 |
x,y,z |
1_555 |
1 |
1 |
129 |
28.4 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.011 |
28 |
46 |
|
[UNX]A:212 |
1 |
1 |
129 |
f |
[UNX]A:210 |
x,y,z |
1_555 |
1 |
1 |
129 |
27.8 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.011 |
29 |
47 |
|
[UNX]B:203 |
1 |
1 |
129 |
f |
[UNX]B:202 |
x,y,z |
1_555 |
1 |
1 |
129 |
25.8 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.010 |
30 |
48 |
|
A |
5 |
3 |
9417 |
◊ |
B |
x,y-1,z-1 |
1_544 |
4 |
3 |
9961 |
25.3 |
0.2 |
0.643 |
0 |
0 |
0 |
0.000 |
31 |
49 |
|
[UNX]A:204 |
1 |
1 |
129 |
f |
[EDO]A:207 |
x,y,z |
1_555 |
4 |
1 |
184 |
25.3 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.001 |
32 |
50 |
|
[UNX]A:211 |
1 |
1 |
129 |
f |
[UNX]A:210 |
x,y,z |
1_555 |
1 |
1 |
129 |
24.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.010 |
33 |
51 |
|
[UNX]A:204 |
1 |
1 |
129 |
f |
[UNX]A:203 |
x,y,z |
1_555 |
1 |
1 |
129 |
23.5 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.018 |
34 |
52 |
|
[EDO]A:208 |
2 |
1 |
184 |
f |
B |
x-1,y,z |
1_455 |
3 |
1 |
9961 |
21.8 |
0.5 |
0.783 |
0 |
0 |
0 |
0.000 |
35 |
53 |
|
[UNX]A:209 |
1 |
1 |
129 |
f |
[EDO]A:202 |
x,y,z |
1_555 |
4 |
1 |
183 |
17.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.005 |
36 |
54 |
|
[UNX]A:210 |
1 |
1 |
129 |
f |
[EDO]B:205 |
x-1,y,z |
1_455 |
2 |
1 |
184 |
16.6 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.002 |
55 |
|
[UNX]A:211 |
1 |
1 |
129 |
f |
[EDO]B:205 |
x-1,y,z |
1_455 |
2 |
1 |
184 |
15.4 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.002 |
Average: |
16.0 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.002 |
37 |
56 |
|
[EDO]A:207 |
2 |
1 |
184 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
3 |
2 |
9961 |
15.3 |
0.3 |
0.869 |
0 |
0 |
0 |
0.000 |
38 |
57 |
|
[UNX]A:203 |
1 |
1 |
129 |
f |
[EDO]A:207 |
x,y,z |
1_555 |
1 |
1 |
184 |
7.8 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
39 |
58 |
|
[UNX]A:212 |
1 |
1 |
129 |
f |
[EDO]B:205 |
x-1,y,z |
1_455 |
1 |
1 |
184 |
5.8 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
40 |
59 |
|
[UNX]B:202 |
1 |
1 |
129 |
f |
[EDO]B:204 |
x,y,z |
1_555 |
1 |
1 |
184 |
2.9 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
41 |
60 |
|
[EDO]A:206 |
2 |
1 |
183 |
f |
B |
x-1,y-1,z-1 |
1_444 |
1 |
1 |
9961 |
1.0 |
0.0 |
0.702 |
0 |
0 |
0 |
0.000 |
|