## |
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 |
|
D |
83 |
25 |
17127 |
◊ |
A |
x,y,z |
1_555 |
83 |
25 |
17158 |
866.4 |
-6.7 |
0.180 |
4 |
0 |
0 |
0.064 |
2 |
|
C |
82 |
26 |
17223 |
◊ |
B |
x-1,y-1,z |
1_445 |
80 |
25 |
17185 |
860.1 |
-5.3 |
0.243 |
4 |
0 |
0 |
0.064 |
Average: |
863.2 |
-6.0 |
0.211 |
4 |
0 |
0 |
0.064 |
2 |
3 |
|
[FAD]C:389 |
53 |
1 |
992 |
f |
C |
x,y,z |
1_555 |
90 |
37 |
17223 |
685.6 |
-5.6 |
0.527 |
11 |
0 |
0 |
0.186 |
4 |
|
[FAD]D:389 |
53 |
1 |
987 |
f |
D |
x,y,z |
1_555 |
91 |
38 |
17127 |
685.5 |
-5.4 |
0.546 |
11 |
0 |
0 |
0.186 |
5 |
|
[FAD]A:389 |
51 |
1 |
989 |
f |
A |
x,y,z |
1_555 |
90 |
37 |
17158 |
684.6 |
-4.7 |
0.515 |
10 |
0 |
0 |
0.186 |
6 |
|
[FAD]B:389 |
52 |
1 |
990 |
f |
B |
x,y,z |
1_555 |
90 |
38 |
17185 |
684.0 |
-5.0 |
0.528 |
12 |
0 |
0 |
0.186 |
Average: |
684.9 |
-5.2 |
0.529 |
11 |
0 |
0 |
0.186 |
3 |
7 |
|
B |
55 |
16 |
17185 |
◊ |
A |
x,y,z |
1_555 |
46 |
16 |
17158 |
455.6 |
-4.9 |
0.152 |
1 |
1 |
0 |
0.000 |
4 |
8 |
|
[MIY]D:391 |
32 |
1 |
612 |
f |
D |
x,y,z |
1_555 |
65 |
24 |
17127 |
412.8 |
-0.7 |
0.488 |
4 |
0 |
0 |
0.054 |
9 |
|
[MIY]A:391 |
32 |
1 |
611 |
f |
A |
x,y,z |
1_555 |
66 |
24 |
17158 |
409.8 |
-0.8 |
0.466 |
5 |
0 |
0 |
0.054 |
10 |
|
[MIY]B:391 |
32 |
1 |
612 |
f |
B |
x,y,z |
1_555 |
66 |
24 |
17185 |
407.9 |
-0.8 |
0.485 |
5 |
0 |
0 |
0.054 |
11 |
|
[MIY]C:391 |
32 |
1 |
612 |
f |
C |
x,y,z |
1_555 |
64 |
24 |
17223 |
406.7 |
-0.8 |
0.472 |
5 |
0 |
0 |
0.054 |
Average: |
409.3 |
-0.8 |
0.477 |
5 |
0 |
0 |
0.054 |
5 |
12 |
|
A |
39 |
12 |
17158 |
◊ |
C |
x,y,z-1 |
1_554 |
40 |
11 |
17223 |
376.1 |
-3.5 |
0.233 |
3 |
1 |
0 |
0.000 |
13 |
|
D |
38 |
11 |
17127 |
◊ |
B |
x,y-1,z-1 |
1_544 |
41 |
12 |
17185 |
373.7 |
-4.0 |
0.202 |
3 |
1 |
0 |
0.000 |
Average: |
374.9 |
-3.8 |
0.218 |
3 |
1 |
0 |
0.000 |
6 |
14 |
|
[MIY]C:392 |
24 |
1 |
609 |
f |
C |
x,y,z |
1_555 |
32 |
9 |
17223 |
226.4 |
-2.2 |
0.321 |
2 |
0 |
0 |
0.027 |
15 |
|
[MIY]D:393 |
26 |
1 |
613 |
f |
D |
x,y,z |
1_555 |
34 |
9 |
17127 |
224.3 |
-2.0 |
0.343 |
2 |
0 |
0 |
0.027 |
Average: |
225.4 |
-2.1 |
0.332 |
2 |
0 |
0 |
0.027 |
7 |
16 |
|
[MIY]A:392 |
22 |
1 |
610 |
f |
C |
x,y,z |
1_555 |
32 |
12 |
17223 |
219.4 |
-2.1 |
0.328 |
0 |
0 |
0 |
0.018 |
17 |
|
[MIY]D:392 |
23 |
1 |
621 |
f |
D |
x,y,z |
1_555 |
32 |
12 |
17127 |
214.9 |
-2.6 |
0.272 |
0 |
0 |
0 |
0.018 |
Average: |
217.1 |
-2.3 |
0.300 |
0 |
0 |
0 |
0.018 |
8 |
18 |
|
D |
26 |
9 |
17127 |
◊ |
B |
x,y-1,z |
1_545 |
20 |
9 |
17185 |
194.4 |
-0.9 |
0.456 |
0 |
0 |
0 |
0.000 |
19 |
|
C |
23 |
9 |
17223 |
◊ |
A |
x,y,z |
1_555 |
20 |
9 |
17158 |
183.3 |
-1.0 |
0.432 |
0 |
0 |
0 |
0.000 |
Average: |
188.8 |
-1.0 |
0.444 |
0 |
0 |
0 |
0.000 |
9 |
20 |
|
[MIY]D:393 |
20 |
1 |
613 |
◊ |
B |
x,y-1,z |
1_545 |
25 |
7 |
17185 |
188.3 |
-2.1 |
0.322 |
0 |
0 |
0 |
0.000 |
21 |
|
[MIY]C:392 |
21 |
1 |
609 |
◊ |
A |
x,y,z |
1_555 |
24 |
7 |
17158 |
184.3 |
-1.8 |
0.350 |
0 |
0 |
0 |
0.000 |
Average: |
186.3 |
-1.9 |
0.336 |
0 |
0 |
0 |
0.000 |
10 |
22 |
|
C |
22 |
6 |
17223 |
◊ |
D |
x-1,y,z |
1_455 |
21 |
7 |
17127 |
164.6 |
0.2 |
0.518 |
1 |
0 |
0 |
0.000 |
23 |
|
D |
21 |
6 |
17127 |
◊ |
C |
x,y,z |
1_555 |
20 |
7 |
17223 |
160.2 |
0.2 |
0.521 |
1 |
0 |
0 |
0.000 |
Average: |
162.4 |
0.2 |
0.520 |
1 |
0 |
0 |
0.000 |
11 |
24 |
|
[MIY]A:392 |
16 |
1 |
610 |
◊ |
A |
x,y,z |
1_555 |
17 |
5 |
17158 |
160.5 |
0.3 |
0.480 |
3 |
0 |
0 |
0.000 |
25 |
|
[MIY]D:392 |
16 |
1 |
621 |
◊ |
B |
x,y-1,z |
1_545 |
20 |
5 |
17185 |
151.1 |
-0.6 |
0.396 |
0 |
0 |
0 |
0.000 |
Average: |
155.8 |
-0.2 |
0.438 |
2 |
0 |
0 |
0.000 |
12 |
26 |
|
[MIY]D:393 |
16 |
1 |
613 |
f |
[MIY]D:392 |
x,y,z |
1_555 |
19 |
1 |
621 |
148.9 |
1.4 |
0.562 |
2 |
0 |
0 |
0.000 |
27 |
|
[MIY]C:392 |
16 |
1 |
609 |
f |
[MIY]A:392 |
x,y,z |
1_555 |
17 |
1 |
610 |
148.4 |
1.2 |
0.543 |
2 |
0 |
0 |
0.000 |
Average: |
148.7 |
1.3 |
0.552 |
2 |
0 |
0 |
0.000 |
13 |
28 |
|
A |
16 |
5 |
17158 |
◊ |
B |
x-1,y,z |
1_455 |
16 |
6 |
17185 |
135.2 |
-0.4 |
0.473 |
1 |
2 |
0 |
0.000 |
14 |
29 |
|
C |
13 |
5 |
17223 |
◊ |
A |
x-1,y,z |
1_455 |
10 |
4 |
17158 |
100.1 |
1.2 |
0.773 |
0 |
0 |
0 |
0.000 |
30 |
|
D |
14 |
5 |
17127 |
◊ |
B |
x-1,y-1,z |
1_445 |
9 |
3 |
17185 |
92.9 |
1.1 |
0.770 |
0 |
0 |
0 |
0.000 |
Average: |
96.5 |
1.1 |
0.772 |
0 |
0 |
0 |
0.000 |
15 |
31 |
|
[SO4]C:1385 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
9 |
3 |
17223 |
84.8 |
-10.6 |
0.860 |
2 |
0 |
0 |
0.103 |
16 |
32 |
|
[SO4]C:1383 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
12 |
3 |
17223 |
76.6 |
-10.3 |
0.809 |
3 |
0 |
0 |
0.104 |
17 |
33 |
|
[SO4]D:1383 |
5 |
1 |
188 |
f |
D |
x,y,z |
1_555 |
10 |
3 |
17127 |
74.2 |
-10.0 |
0.800 |
4 |
0 |
0 |
0.025 |
18 |
34 |
|
[SO4]B:1383 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
17185 |
73.7 |
-9.8 |
0.801 |
3 |
0 |
0 |
0.099 |
19 |
35 |
|
[SO4]B:1385 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
17185 |
71.7 |
-8.6 |
0.789 |
2 |
0 |
0 |
0.085 |
20 |
36 |
|
[MIY]D:391 |
7 |
1 |
612 |
f |
[FAD]D:389 |
x,y,z |
1_555 |
9 |
1 |
987 |
70.3 |
1.2 |
0.733 |
1 |
0 |
0 |
0.000 |
37 |
|
[MIY]C:391 |
6 |
1 |
612 |
f |
[FAD]C:389 |
x,y,z |
1_555 |
9 |
1 |
992 |
68.8 |
1.2 |
0.739 |
1 |
0 |
0 |
0.000 |
38 |
|
[MIY]B:391 |
8 |
1 |
612 |
f |
[FAD]B:389 |
x,y,z |
1_555 |
8 |
1 |
990 |
68.7 |
1.2 |
0.718 |
1 |
0 |
0 |
0.000 |
39 |
|
[MIY]A:391 |
7 |
1 |
611 |
f |
[FAD]A:389 |
x,y,z |
1_555 |
9 |
1 |
989 |
68.7 |
1.3 |
0.725 |
1 |
0 |
0 |
0.000 |
Average: |
69.1 |
1.2 |
0.729 |
1 |
0 |
0 |
0.000 |
21 |
40 |
|
[SO4]B:1384 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
17185 |
69.6 |
-8.1 |
0.943 |
4 |
0 |
0 |
0.088 |
22 |
41 |
|
[SO4]A:1383 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
17158 |
69.2 |
-8.0 |
0.953 |
4 |
0 |
0 |
0.046 |
23 |
42 |
|
[SO4]D:1384 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
17127 |
68.3 |
-8.1 |
0.944 |
4 |
0 |
0 |
0.021 |
24 |
43 |
|
[SO4]C:1384 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
8 |
5 |
17223 |
65.1 |
-7.4 |
0.957 |
4 |
0 |
0 |
0.082 |
25 |
44 |
|
[SO4]D:1385 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
17127 |
64.8 |
-7.4 |
0.918 |
2 |
0 |
0 |
0.017 |
26 |
45 |
|
D |
6 |
3 |
17127 |
◊ |
A |
x,y-1,z |
1_545 |
8 |
4 |
17158 |
59.7 |
-1.3 |
0.177 |
0 |
0 |
0 |
0.000 |
27 |
46 |
|
[SO4]C:1383 |
4 |
1 |
187 |
◊ |
B |
x-1,y-1,z |
1_445 |
3 |
1 |
17185 |
37.3 |
-3.2 |
0.967 |
2 |
0 |
0 |
0.037 |
28 |
47 |
|
C |
3 |
1 |
17223 |
◊ |
[SO4]B:1383 |
x-1,y-1,z |
1_445 |
4 |
1 |
187 |
34.7 |
-3.3 |
0.966 |
2 |
0 |
0 |
0.037 |
29 |
48 |
|
[SO4]D:1383 |
4 |
1 |
188 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
17158 |
34.3 |
-3.0 |
0.964 |
2 |
0 |
0 |
0.005 |
30 |
49 |
|
C |
4 |
2 |
17223 |
x |
C |
x-1,y,z |
1_455 |
3 |
2 |
17223 |
18.1 |
0.4 |
0.737 |
0 |
0 |
0 |
0.000 |
50 |
|
D |
4 |
2 |
17127 |
x |
D |
x-1,y,z |
1_455 |
3 |
2 |
17127 |
17.2 |
0.4 |
0.735 |
0 |
0 |
0 |
0.000 |
51 |
|
A |
2 |
2 |
17158 |
x |
A |
x-1,y,z |
1_455 |
2 |
2 |
17158 |
8.6 |
-0.0 |
0.517 |
0 |
0 |
0 |
0.000 |
52 |
|
B |
1 |
1 |
17185 |
x |
B |
x-1,y,z |
1_455 |
2 |
1 |
17185 |
8.4 |
-0.0 |
0.537 |
0 |
0 |
0 |
0.000 |
Average: |
13.1 |
0.2 |
0.632 |
0 |
0 |
0 |
0.000 |
31 |
53 |
|
[SO4]C:1383 |
2 |
1 |
187 |
◊ |
[SO4]B:1383 |
x-1,y-1,z |
1_445 |
2 |
1 |
187 |
9.1 |
-2.2 |
0.960 |
0 |
0 |
0 |
0.020 |
32 |
54 |
|
[SO4]D:1385 |
1 |
1 |
186 |
f |
[FAD]D:389 |
x,y,z |
1_555 |
2 |
1 |
987 |
7.5 |
-0.7 |
0.701 |
0 |
0 |
0 |
0.002 |
33 |
55 |
|
[SO4]C:1385 |
1 |
1 |
187 |
f |
[FAD]C:389 |
x,y,z |
1_555 |
3 |
1 |
992 |
6.4 |
-0.7 |
0.677 |
0 |
0 |
0 |
0.006 |
34 |
56 |
|
[SO4]B:1385 |
1 |
1 |
186 |
f |
[FAD]B:389 |
x,y,z |
1_555 |
1 |
1 |
990 |
5.8 |
-0.5 |
0.754 |
0 |
0 |
0 |
0.004 |
|