## |
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 |
80 |
26 |
15064 |
◊ |
A |
x,y,z |
1_555 |
81 |
26 |
14853 |
762.8 |
-6.8 |
0.214 |
9 |
0 |
0 |
0.000 |
2 |
2 |
|
A |
47 |
17 |
14853 |
x |
A |
-x,y-1/2,-z |
2_545 |
49 |
18 |
14853 |
421.9 |
-1.6 |
0.284 |
5 |
0 |
0 |
0.000 |
3 |
|
B |
47 |
19 |
15064 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
47 |
17 |
15064 |
408.2 |
-2.1 |
0.335 |
3 |
0 |
0 |
0.000 |
Average: |
415.0 |
-1.9 |
0.310 |
4 |
0 |
0 |
0.000 |
3 |
4 |
|
[FMN]B:401 |
30 |
1 |
603 |
f |
B |
x,y,z |
1_555 |
56 |
25 |
15064 |
402.2 |
-2.7 |
0.640 |
16 |
0 |
0 |
0.000 |
5 |
|
[FMN]A:401 |
30 |
1 |
599 |
f |
A |
x,y,z |
1_555 |
58 |
25 |
14853 |
400.0 |
-2.2 |
0.649 |
15 |
0 |
0 |
0.000 |
Average: |
401.1 |
-2.4 |
0.644 |
16 |
0 |
0 |
0.000 |
4 |
6 |
|
[EPE]B:402 |
14 |
1 |
397 |
◊ |
B |
x,y,z |
1_555 |
37 |
11 |
15064 |
220.2 |
5.4 |
0.282 |
3 |
0 |
0 |
0.000 |
7 |
|
[EPE]A:402 |
14 |
1 |
398 |
◊ |
A |
x,y,z |
1_555 |
36 |
11 |
14853 |
210.4 |
5.0 |
0.247 |
3 |
0 |
0 |
0.000 |
Average: |
215.3 |
5.2 |
0.265 |
3 |
0 |
0 |
0.000 |
5 |
8 |
|
B |
18 |
9 |
15064 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
25 |
11 |
14853 |
166.1 |
3.4 |
0.879 |
3 |
1 |
0 |
0.000 |
6 |
9 |
|
[EDO]A:408 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
14853 |
111.3 |
2.7 |
0.359 |
2 |
0 |
0 |
0.000 |
7 |
10 |
|
[EDO]A:404 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
14853 |
111.0 |
2.5 |
0.355 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
13 |
4 |
14853 |
◊ |
B |
x-1,y,z |
1_455 |
13 |
4 |
15064 |
108.8 |
0.2 |
0.638 |
2 |
1 |
0 |
0.000 |
9 |
12 |
|
[EDO]A:407 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
20 |
7 |
14853 |
99.5 |
3.2 |
0.482 |
3 |
0 |
0 |
0.000 |
10 |
13 |
|
[EDO]B:403 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
13 |
6 |
15064 |
99.5 |
2.8 |
0.444 |
4 |
0 |
0 |
0.000 |
11 |
14 |
|
[EDO]A:406 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
14853 |
92.0 |
2.6 |
0.437 |
5 |
0 |
0 |
0.000 |
12 |
15 |
|
B |
13 |
7 |
15064 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
3 |
14853 |
86.5 |
1.6 |
0.801 |
1 |
2 |
0 |
0.000 |
16 |
|
B |
7 |
3 |
15064 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
12 |
6 |
14853 |
71.4 |
2.0 |
0.840 |
1 |
2 |
0 |
0.000 |
Average: |
78.9 |
1.8 |
0.820 |
1 |
2 |
0 |
0.000 |
13 |
17 |
|
[EDO]A:405 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
12 |
3 |
14853 |
84.7 |
1.7 |
0.200 |
2 |
0 |
0 |
0.000 |
14 |
18 |
|
[EDO]B:406 |
4 |
1 |
185 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
15 |
7 |
15064 |
83.8 |
2.4 |
0.281 |
2 |
0 |
0 |
0.000 |
15 |
19 |
|
[EDO]B:405 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
15064 |
83.0 |
2.3 |
0.244 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
[EDO]B:413 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
15064 |
80.4 |
2.7 |
0.315 |
2 |
0 |
0 |
0.000 |
17 |
21 |
|
[EDO]B:404 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
15064 |
77.0 |
2.2 |
0.245 |
1 |
0 |
0 |
0.000 |
22 |
|
[EDO]A:403 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
14853 |
72.1 |
2.3 |
0.244 |
0 |
0 |
0 |
0.000 |
Average: |
74.5 |
2.2 |
0.245 |
1 |
0 |
0 |
0.000 |
18 |
23 |
|
[EDO]A:410 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
14853 |
75.1 |
1.4 |
0.752 |
2 |
0 |
0 |
0.000 |
19 |
24 |
|
[EDO]A:411 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
14853 |
73.0 |
2.9 |
0.952 |
2 |
0 |
0 |
0.000 |
20 |
25 |
|
[EPE]B:402 |
6 |
1 |
397 |
◊ |
[FMN]B:401 |
x,y,z |
1_555 |
17 |
1 |
603 |
70.0 |
2.6 |
0.177 |
0 |
0 |
0 |
0.000 |
26 |
|
[EPE]A:402 |
6 |
1 |
398 |
◊ |
[FMN]A:401 |
x,y,z |
1_555 |
17 |
1 |
599 |
66.6 |
2.5 |
0.168 |
0 |
0 |
0 |
0.000 |
Average: |
68.3 |
2.6 |
0.173 |
0 |
0 |
0 |
0.000 |
21 |
27 |
|
B |
6 |
3 |
15064 |
f |
[EDO]B:407 |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
184 |
65.3 |
0.9 |
0.301 |
0 |
0 |
0 |
0.000 |
22 |
28 |
|
[EDO]B:411 |
3 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
15064 |
57.9 |
1.6 |
0.851 |
1 |
0 |
0 |
0.000 |
23 |
29 |
|
[EDO]B:410 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
15064 |
48.5 |
0.2 |
0.239 |
0 |
0 |
0 |
0.000 |
24 |
30 |
|
[EDO]B:409 |
3 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
15064 |
44.1 |
1.4 |
0.871 |
1 |
0 |
0 |
0.000 |
25 |
31 |
|
[EDO]A:409 |
3 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
14853 |
43.0 |
0.3 |
0.256 |
0 |
0 |
0 |
0.000 |
26 |
32 |
|
[EDO]B:410 |
4 |
1 |
184 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
1 |
14853 |
38.9 |
0.3 |
0.406 |
0 |
0 |
0 |
0.000 |
27 |
33 |
|
A |
4 |
1 |
14853 |
◊ |
B |
x,y,z-1 |
1_554 |
9 |
6 |
15064 |
36.0 |
0.8 |
0.794 |
0 |
0 |
0 |
0.000 |
28 |
34 |
|
[EDO]A:409 |
3 |
1 |
185 |
f |
[EDO]A:406 |
x,y,z |
1_555 |
2 |
1 |
182 |
36.0 |
2.3 |
0.707 |
0 |
0 |
0 |
0.000 |
29 |
35 |
|
[EDO]B:404 |
2 |
1 |
185 |
f |
[EPE]B:402 |
x,y,z |
1_555 |
4 |
1 |
397 |
35.6 |
1.2 |
0.103 |
1 |
0 |
0 |
0.000 |
36 |
|
[EDO]A:403 |
2 |
1 |
185 |
f |
[EPE]A:402 |
x,y,z |
1_555 |
4 |
1 |
398 |
34.7 |
1.1 |
0.091 |
1 |
0 |
0 |
0.000 |
Average: |
35.2 |
1.1 |
0.097 |
1 |
0 |
0 |
0.000 |
30 |
37 |
|
[EDO]A:403 |
2 |
1 |
185 |
◊ |
[FMN]A:401 |
x,y,z |
1_555 |
6 |
1 |
599 |
27.6 |
0.9 |
0.881 |
0 |
0 |
0 |
0.000 |
38 |
|
[EDO]B:404 |
1 |
1 |
185 |
◊ |
[FMN]B:401 |
x,y,z |
1_555 |
6 |
1 |
603 |
27.4 |
0.9 |
0.881 |
0 |
0 |
0 |
0.000 |
Average: |
27.5 |
0.9 |
0.881 |
0 |
0 |
0 |
0.000 |
31 |
39 |
|
[EDO]A:409 |
2 |
1 |
185 |
◊ |
[EPE]A:402 |
x,y,z |
1_555 |
3 |
1 |
398 |
25.7 |
1.0 |
0.267 |
0 |
0 |
0 |
0.000 |
32 |
40 |
|
[EDO]B:407 |
2 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
15064 |
23.8 |
1.0 |
0.962 |
0 |
0 |
0 |
0.000 |
33 |
41 |
|
[EDO]A:405 |
2 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
15064 |
23.7 |
0.6 |
0.626 |
0 |
0 |
0 |
0.000 |
34 |
42 |
|
A |
5 |
4 |
14853 |
x |
A |
x-1,y,z |
1_455 |
3 |
1 |
14853 |
23.4 |
0.2 |
0.714 |
0 |
0 |
0 |
0.000 |
35 |
43 |
|
[EDO]A:403 |
2 |
1 |
185 |
f |
A |
-x,y-1/2,-z |
2_545 |
3 |
1 |
14853 |
21.3 |
0.5 |
0.644 |
0 |
0 |
0 |
0.000 |
44 |
|
B |
5 |
1 |
15064 |
f |
[EDO]B:404 |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
185 |
20.1 |
0.5 |
0.792 |
0 |
0 |
0 |
0.000 |
Average: |
20.7 |
0.5 |
0.718 |
0 |
0 |
0 |
0.000 |
36 |
45 |
|
[EDO]A:406 |
2 |
1 |
182 |
◊ |
[EPE]A:402 |
x,y,z |
1_555 |
2 |
1 |
398 |
14.8 |
1.0 |
0.427 |
0 |
0 |
0 |
0.000 |
37 |
46 |
|
[EDO]B:406 |
1 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
15064 |
13.9 |
0.6 |
0.881 |
0 |
0 |
0 |
0.000 |
38 |
47 |
|
[EDO]B:403 |
2 |
1 |
184 |
f |
[EPE]B:402 |
x,y,z |
1_555 |
2 |
1 |
397 |
12.1 |
0.8 |
0.394 |
0 |
0 |
0 |
0.000 |
39 |
48 |
|
[EDO]B:412 |
2 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
2 |
1 |
15064 |
8.3 |
0.4 |
0.888 |
0 |
0 |
0 |
0.000 |
40 |
49 |
|
[EDO]B:410 |
1 |
1 |
184 |
f |
[EDO]A:405 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
182 |
4.5 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
41 |
50 |
|
[EDO]B:408 |
1 |
1 |
182 |
f |
[EDO]B:403 |
x,y,z |
1_555 |
1 |
1 |
184 |
2.7 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
42 |
51 |
|
[EDO]B:413 |
1 |
1 |
184 |
f |
[EDO]B:412 |
x,y,z |
1_555 |
1 |
1 |
185 |
2.3 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
43 |
52 |
|
A |
1 |
1 |
14853 |
f |
[EDO]A:411 |
x-1,y,z |
1_455 |
1 |
1 |
185 |
1.6 |
0.0 |
0.855 |
0 |
0 |
0 |
0.000 |
|