## |
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 |
|
L |
143 |
34 |
9277 |
◊ |
G |
x,y,z |
1_555 |
146 |
33 |
9242 |
1338.9 |
-7.8 |
0.764 |
17 |
0 |
0 |
0.401 |
2 |
|
B |
149 |
33 |
9084 |
◊ |
B |
-x-1,-y,z |
2_455 |
149 |
33 |
9084 |
1334.4 |
-7.8 |
0.744 |
16 |
2 |
0 |
0.401 |
3 |
|
I |
142 |
35 |
9130 |
◊ |
H |
x,y,z |
1_555 |
143 |
32 |
9540 |
1334.1 |
-8.0 |
0.657 |
17 |
0 |
0 |
0.401 |
4 |
|
A |
146 |
34 |
9153 |
◊ |
A |
-x-1,-y,z |
2_455 |
145 |
33 |
9153 |
1333.1 |
-8.3 |
0.701 |
18 |
2 |
0 |
0.401 |
5 |
|
F |
144 |
33 |
9139 |
◊ |
E |
x,y,z |
1_555 |
145 |
33 |
9051 |
1309.1 |
-7.9 |
0.750 |
19 |
0 |
0 |
0.401 |
6 |
|
K |
147 |
32 |
9186 |
◊ |
J |
x,y,z |
1_555 |
140 |
33 |
9231 |
1304.7 |
-9.3 |
0.652 |
18 |
0 |
0 |
0.401 |
7 |
|
D |
141 |
32 |
9193 |
◊ |
C |
x,y,z |
1_555 |
144 |
33 |
9092 |
1301.0 |
-8.6 |
0.718 |
16 |
0 |
0 |
0.401 |
Average: |
1322.2 |
-8.3 |
0.712 |
17 |
1 |
0 |
0.401 |
2 |
8 |
|
J |
81 |
20 |
9231 |
◊ |
H |
x,y,z |
1_555 |
69 |
18 |
9540 |
738.7 |
-3.4 |
0.710 |
7 |
2 |
0 |
0.138 |
9 |
|
D |
74 |
19 |
9193 |
◊ |
D |
-x,-y,z |
2_555 |
75 |
19 |
9193 |
722.4 |
-4.9 |
0.640 |
8 |
2 |
0 |
0.138 |
10 |
|
K |
74 |
18 |
9186 |
◊ |
I |
x,y,z |
1_555 |
72 |
18 |
9130 |
718.7 |
-4.3 |
0.615 |
3 |
2 |
0 |
0.138 |
11 |
|
C |
73 |
17 |
9092 |
◊ |
C |
-x,-y,z |
2_555 |
73 |
17 |
9092 |
708.9 |
-4.5 |
0.653 |
4 |
2 |
0 |
0.138 |
12 |
|
G |
69 |
18 |
9242 |
◊ |
E |
x,y,z |
1_555 |
73 |
19 |
9051 |
701.9 |
-4.7 |
0.645 |
8 |
2 |
0 |
0.138 |
13 |
|
B |
74 |
18 |
9084 |
◊ |
A |
x,y,z |
1_555 |
71 |
17 |
9153 |
700.9 |
-4.7 |
0.608 |
7 |
2 |
0 |
0.138 |
14 |
|
L |
71 |
18 |
9277 |
◊ |
F |
x,y,z |
1_555 |
72 |
19 |
9139 |
691.5 |
-3.9 |
0.678 |
6 |
3 |
0 |
0.138 |
Average: |
711.9 |
-4.3 |
0.650 |
6 |
2 |
0 |
0.138 |
3 |
15 |
|
D |
37 |
9 |
9193 |
◊ |
C |
-x,-y,z |
2_555 |
43 |
11 |
9092 |
391.9 |
-5.1 |
0.338 |
4 |
0 |
0 |
0.120 |
16 |
|
J |
35 |
9 |
9231 |
◊ |
I |
x,y,z |
1_555 |
41 |
11 |
9130 |
376.4 |
-4.1 |
0.403 |
4 |
0 |
0 |
0.120 |
17 |
|
G |
39 |
11 |
9242 |
◊ |
F |
x,y,z |
1_555 |
39 |
11 |
9139 |
375.1 |
-4.1 |
0.422 |
4 |
0 |
0 |
0.120 |
18 |
|
K |
33 |
10 |
9186 |
◊ |
H |
x,y,z |
1_555 |
34 |
9 |
9540 |
362.5 |
-4.5 |
0.283 |
4 |
0 |
0 |
0.120 |
19 |
|
L |
36 |
9 |
9277 |
◊ |
E |
x,y,z |
1_555 |
38 |
11 |
9051 |
358.9 |
-5.0 |
0.294 |
4 |
0 |
0 |
0.120 |
20 |
|
B |
34 |
9 |
9084 |
◊ |
A |
-x-1,-y,z |
2_455 |
31 |
9 |
9153 |
331.4 |
-4.4 |
0.298 |
4 |
0 |
0 |
0.120 |
Average: |
366.0 |
-4.5 |
0.339 |
4 |
0 |
0 |
0.120 |
4 |
21 |
|
F |
40 |
13 |
9139 |
◊ |
A |
x,y,z |
1_555 |
42 |
12 |
9153 |
391.4 |
-3.5 |
0.477 |
2 |
0 |
0 |
0.031 |
22 |
|
H |
34 |
11 |
9540 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
34 |
10 |
9051 |
329.7 |
-4.2 |
0.344 |
2 |
0 |
0 |
0.031 |
Average: |
360.6 |
-3.9 |
0.411 |
2 |
0 |
0 |
0.031 |
5 |
23 |
|
[FMN]I:201 |
30 |
1 |
623 |
f |
I |
x,y,z |
1_555 |
50 |
19 |
9130 |
347.5 |
-5.8 |
0.589 |
12 |
0 |
0 |
0.561 |
24 |
|
[FMN]L:201 |
30 |
1 |
615 |
f |
L |
x,y,z |
1_555 |
55 |
18 |
9277 |
345.5 |
-7.2 |
0.548 |
11 |
0 |
0 |
0.561 |
25 |
|
[FMN]D:201 |
30 |
1 |
618 |
f |
D |
x,y,z |
1_555 |
50 |
17 |
9193 |
344.6 |
-6.3 |
0.578 |
12 |
0 |
0 |
0.561 |
26 |
|
[FMN]E:201 |
30 |
1 |
617 |
f |
E |
x,y,z |
1_555 |
50 |
17 |
9051 |
341.6 |
-6.6 |
0.564 |
12 |
0 |
0 |
0.561 |
27 |
|
[FMN]F:201 |
30 |
1 |
613 |
f |
F |
x,y,z |
1_555 |
51 |
18 |
9139 |
338.5 |
-6.1 |
0.571 |
13 |
0 |
0 |
0.561 |
28 |
|
[FMN]C:201 |
30 |
1 |
615 |
f |
C |
x,y,z |
1_555 |
50 |
17 |
9092 |
338.2 |
-6.3 |
0.572 |
13 |
0 |
0 |
0.561 |
29 |
|
[FMN]B:201 |
30 |
1 |
614 |
f |
B |
x,y,z |
1_555 |
51 |
17 |
9084 |
337.5 |
-6.9 |
0.537 |
12 |
0 |
0 |
0.561 |
30 |
|
[FMN]A:201 |
30 |
1 |
614 |
f |
A |
x,y,z |
1_555 |
53 |
18 |
9153 |
333.9 |
-6.3 |
0.567 |
14 |
0 |
0 |
0.561 |
31 |
|
[FMN]K:201 |
30 |
1 |
609 |
f |
K |
x,y,z |
1_555 |
50 |
18 |
9186 |
333.1 |
-6.2 |
0.552 |
13 |
0 |
0 |
0.561 |
32 |
|
[FMN]H:201 |
29 |
1 |
615 |
f |
H |
x,y,z |
1_555 |
49 |
18 |
9540 |
329.0 |
-5.2 |
0.554 |
15 |
0 |
0 |
0.561 |
Average: |
339.0 |
-6.3 |
0.563 |
13 |
0 |
0 |
0.561 |
6 |
33 |
|
[FMN]G:201 |
29 |
1 |
605 |
f |
G |
x,y,z |
1_555 |
51 |
17 |
9242 |
342.9 |
-7.4 |
0.492 |
9 |
0 |
0 |
0.271 |
7 |
34 |
|
[FMN]J:201 |
30 |
1 |
605 |
f |
J |
x,y,z |
1_555 |
52 |
19 |
9231 |
336.1 |
-4.6 |
0.636 |
10 |
0 |
0 |
0.210 |
8 |
35 |
|
C |
33 |
12 |
9092 |
◊ |
A |
x,y,z |
1_555 |
36 |
11 |
9153 |
315.4 |
-3.8 |
0.413 |
1 |
0 |
0 |
0.000 |
9 |
36 |
|
D |
31 |
12 |
9193 |
◊ |
B |
x,y,z-1 |
1_554 |
27 |
9 |
9084 |
286.7 |
-4.7 |
0.242 |
1 |
0 |
0 |
0.000 |
10 |
37 |
|
E |
25 |
8 |
9051 |
◊ |
A |
x,y,z |
1_555 |
33 |
11 |
9153 |
285.7 |
-0.2 |
0.770 |
3 |
0 |
0 |
0.011 |
38 |
|
I |
27 |
6 |
9130 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
27 |
9 |
9051 |
208.3 |
-0.7 |
0.686 |
2 |
0 |
0 |
0.011 |
Average: |
247.0 |
-0.5 |
0.728 |
3 |
0 |
0 |
0.011 |
11 |
39 |
|
E |
30 |
10 |
9051 |
◊ |
J |
x,y,z-1 |
1_554 |
28 |
9 |
9231 |
281.9 |
-0.4 |
0.764 |
2 |
0 |
0 |
0.000 |
40 |
|
I |
28 |
9 |
9130 |
◊ |
L |
x-1,y,z |
1_455 |
23 |
7 |
9277 |
240.7 |
-1.8 |
0.526 |
1 |
0 |
0 |
0.000 |
Average: |
261.3 |
-1.1 |
0.645 |
2 |
0 |
0 |
0.000 |
12 |
41 |
|
K |
24 |
8 |
9186 |
◊ |
G |
x-1,y,z+1 |
1_456 |
27 |
10 |
9242 |
254.8 |
-4.1 |
0.247 |
1 |
0 |
0 |
0.000 |
13 |
42 |
|
F |
31 |
7 |
9139 |
◊ |
B |
-x-1,-y,z |
2_455 |
22 |
8 |
9084 |
242.3 |
-1.5 |
0.568 |
5 |
0 |
0 |
0.021 |
43 |
|
H |
28 |
7 |
9540 |
◊ |
L |
x-1/2,-y+1/2,-z |
4_455 |
22 |
8 |
9277 |
217.8 |
-2.1 |
0.499 |
1 |
0 |
0 |
0.021 |
Average: |
230.0 |
-1.8 |
0.534 |
3 |
0 |
0 |
0.021 |
14 |
44 |
|
K |
20 |
8 |
9186 |
◊ |
H |
x-1/2,-y+1/2,-z+1 |
4_456 |
18 |
6 |
9540 |
167.4 |
-2.1 |
0.389 |
1 |
0 |
0 |
0.000 |
15 |
45 |
|
H |
16 |
7 |
9540 |
◊ |
F |
x,y,z |
1_555 |
19 |
6 |
9139 |
156.1 |
-2.3 |
0.360 |
1 |
0 |
0 |
0.000 |
16 |
46 |
|
[FMN]H:201 |
12 |
1 |
615 |
◊ |
I |
x,y,z |
1_555 |
24 |
6 |
9130 |
143.6 |
-2.1 |
0.551 |
0 |
0 |
0 |
0.089 |
47 |
|
[FMN]K:201 |
13 |
1 |
609 |
◊ |
J |
x,y,z |
1_555 |
26 |
7 |
9231 |
142.4 |
-2.2 |
0.604 |
0 |
0 |
0 |
0.089 |
48 |
|
[FMN]B:201 |
13 |
1 |
614 |
◊ |
B |
-x-1,-y,z |
2_455 |
26 |
6 |
9084 |
128.1 |
-1.9 |
0.610 |
0 |
0 |
0 |
0.089 |
49 |
|
[FMN]A:201 |
13 |
1 |
614 |
◊ |
A |
-x-1,-y,z |
2_455 |
24 |
6 |
9153 |
127.8 |
-2.0 |
0.583 |
0 |
0 |
0 |
0.089 |
50 |
|
[FMN]C:201 |
13 |
1 |
615 |
◊ |
D |
x,y,z |
1_555 |
26 |
6 |
9193 |
126.4 |
-1.8 |
0.628 |
0 |
0 |
0 |
0.089 |
51 |
|
[FMN]F:201 |
12 |
1 |
613 |
◊ |
E |
x,y,z |
1_555 |
23 |
6 |
9051 |
125.0 |
-1.8 |
0.596 |
0 |
0 |
0 |
0.089 |
52 |
|
[FMN]E:201 |
9 |
1 |
617 |
◊ |
F |
x,y,z |
1_555 |
21 |
6 |
9139 |
123.3 |
-1.9 |
0.552 |
0 |
0 |
0 |
0.089 |
53 |
|
[FMN]D:201 |
11 |
1 |
618 |
◊ |
C |
x,y,z |
1_555 |
26 |
6 |
9092 |
121.6 |
-1.7 |
0.613 |
0 |
0 |
0 |
0.089 |
54 |
|
[FMN]L:201 |
13 |
1 |
615 |
◊ |
G |
x,y,z |
1_555 |
22 |
6 |
9242 |
115.9 |
-1.8 |
0.623 |
0 |
0 |
0 |
0.089 |
Average: |
128.2 |
-1.9 |
0.596 |
0 |
0 |
0 |
0.089 |
17 |
55 |
|
[FMN]G:201 |
16 |
1 |
605 |
◊ |
L |
x,y,z |
1_555 |
21 |
6 |
9277 |
135.4 |
-0.5 |
0.678 |
2 |
0 |
0 |
0.032 |
18 |
56 |
|
[FMN]J:201 |
12 |
1 |
605 |
◊ |
K |
x,y,z |
1_555 |
22 |
6 |
9186 |
134.6 |
-2.6 |
0.501 |
0 |
0 |
0 |
0.060 |
57 |
|
[FMN]I:201 |
9 |
1 |
623 |
◊ |
H |
x,y,z |
1_555 |
19 |
6 |
9540 |
108.8 |
-1.9 |
0.505 |
0 |
0 |
0 |
0.060 |
Average: |
121.7 |
-2.2 |
0.503 |
0 |
0 |
0 |
0.060 |
19 |
58 |
|
C |
10 |
3 |
9092 |
◊ |
J |
-x-1,-y,z-1 |
2_454 |
18 |
6 |
9231 |
117.7 |
-1.3 |
0.520 |
1 |
0 |
0 |
0.000 |
20 |
59 |
|
A |
12 |
3 |
9153 |
◊ |
J |
-x-1,-y,z-1 |
2_454 |
9 |
3 |
9231 |
74.0 |
-0.3 |
0.629 |
0 |
0 |
0 |
0.000 |
21 |
60 |
|
I |
4 |
1 |
9130 |
◊ |
B |
-x-1,-y,z |
2_455 |
14 |
8 |
9084 |
68.9 |
1.3 |
0.891 |
3 |
0 |
0 |
0.000 |
22 |
61 |
|
G |
7 |
3 |
9242 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
9153 |
56.9 |
-0.8 |
0.408 |
0 |
0 |
0 |
0.003 |
62 |
|
K |
7 |
3 |
9186 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
5 |
1 |
9051 |
45.5 |
-0.2 |
0.568 |
0 |
0 |
0 |
0.003 |
Average: |
51.2 |
-0.5 |
0.488 |
0 |
0 |
0 |
0.003 |
23 |
63 |
|
[FMN]F:201 |
8 |
1 |
613 |
◊ |
A |
x,y,z |
1_555 |
3 |
3 |
9153 |
56.7 |
-0.3 |
0.280 |
0 |
0 |
0 |
0.000 |
64 |
|
[FMN]H:201 |
7 |
1 |
615 |
◊ |
E |
x-1/2,-y+1/2,-z |
4_455 |
3 |
3 |
9051 |
40.9 |
0.3 |
0.356 |
0 |
0 |
0 |
0.000 |
Average: |
48.8 |
-0.0 |
0.318 |
0 |
0 |
0 |
0.000 |
24 |
65 |
|
I |
4 |
1 |
9130 |
◊ |
D |
x-1,y,z+1 |
1_456 |
4 |
2 |
9193 |
34.8 |
-0.3 |
0.495 |
0 |
0 |
0 |
0.000 |
25 |
66 |
|
H |
3 |
1 |
9540 |
◊ |
[FMN]L:201 |
x-1/2,-y+1/2,-z |
4_455 |
5 |
1 |
615 |
21.2 |
0.0 |
0.462 |
0 |
0 |
0 |
0.000 |
67 |
|
[FMN]B:201 |
3 |
1 |
614 |
◊ |
F |
-x-1,-y,z |
2_455 |
3 |
2 |
9139 |
6.2 |
0.1 |
0.632 |
0 |
0 |
0 |
0.000 |
Average: |
13.7 |
0.1 |
0.547 |
0 |
0 |
0 |
0.000 |
26 |
68 |
|
H |
3 |
2 |
9540 |
◊ |
G |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
9242 |
18.1 |
-0.3 |
0.413 |
0 |
0 |
0 |
0.000 |
27 |
69 |
|
C |
1 |
1 |
9092 |
◊ |
I |
-x-1,-y,z-1 |
2_454 |
1 |
1 |
9130 |
3.7 |
0.1 |
0.795 |
0 |
0 |
0 |
0.000 |
28 |
70 |
|
D |
1 |
1 |
9193 |
◊ |
F |
x,y,z-1 |
1_554 |
1 |
1 |
9139 |
3.4 |
-0.0 |
0.549 |
0 |
0 |
0 |
0.000 |
29 |
71 |
|
H |
1 |
1 |
9540 |
◊ |
B |
-x-1,-y,z |
2_455 |
1 |
1 |
9084 |
0.5 |
0.0 |
0.657 |
0 |
0 |
0 |
0.000 |
|