| ## |
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 |
221 |
50 |
15834 |
◊ |
A |
x,y,z |
1_555 |
228 |
61 |
14925 |
2135.1 |
-19.7 |
0.141 |
27 |
6 |
0 |
0.729 |
2 |
|
C |
231 |
61 |
14874 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
218 |
50 |
15811 |
2129.9 |
-19.4 |
0.153 |
29 |
7 |
0 |
0.729 |
| Average: |
2132.5 |
-19.6 |
0.147 |
28 |
7 |
0 |
0.729 |
| 2 |
3 |
|
D |
89 |
30 |
15811 |
◊ |
B |
x,y,z |
1_555 |
92 |
31 |
15834 |
923.6 |
-10.2 |
0.132 |
8 |
4 |
0 |
0.763 |
| 3 |
4 |
|
D |
41 |
14 |
15811 |
◊ |
A |
x,y,z |
1_555 |
40 |
10 |
14925 |
404.6 |
-3.9 |
0.245 |
1 |
0 |
0 |
0.080 |
5 |
|
C |
38 |
10 |
14874 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
40 |
14 |
15834 |
402.8 |
-4.4 |
0.159 |
1 |
0 |
0 |
0.080 |
| Average: |
403.7 |
-4.2 |
0.202 |
1 |
0 |
0 |
0.080 |
| 4 |
6 |
|
C |
43 |
16 |
14874 |
◊ |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
48 |
16 |
15834 |
389.0 |
-0.8 |
0.594 |
3 |
2 |
0 |
0.000 |
7 |
|
A |
43 |
16 |
14925 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
52 |
17 |
15811 |
383.3 |
-1.0 |
0.565 |
2 |
2 |
0 |
0.000 |
| Average: |
386.1 |
-0.9 |
0.580 |
3 |
2 |
0 |
0.000 |
| 5 |
8 |
|
[FMN]A:401 |
30 |
1 |
602 |
f |
A |
x,y,z |
1_555 |
56 |
27 |
14925 |
358.9 |
-4.6 |
0.552 |
15 |
0 |
0 |
0.248 |
9 |
|
[FMN]C:401 |
30 |
1 |
601 |
f |
C |
x,y,z |
1_555 |
57 |
27 |
14874 |
357.8 |
-4.6 |
0.569 |
15 |
0 |
0 |
0.248 |
| Average: |
358.4 |
-4.6 |
0.561 |
15 |
0 |
0 |
0.248 |
| 6 |
10 |
|
C |
27 |
10 |
14874 |
◊ |
A |
-x+1,y-1/2,-z-1/2 |
3_644 |
27 |
10 |
14925 |
282.2 |
-0.4 |
0.585 |
3 |
0 |
0 |
0.000 |
11 |
|
C |
27 |
10 |
14874 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
26 |
10 |
14925 |
280.8 |
-0.5 |
0.561 |
2 |
0 |
0 |
0.000 |
| Average: |
281.5 |
-0.5 |
0.573 |
3 |
0 |
0 |
0.000 |
| 7 |
12 |
|
A |
27 |
10 |
14925 |
◊ |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
29 |
11 |
15834 |
233.7 |
2.1 |
0.737 |
2 |
4 |
0 |
0.000 |
| 8 |
13 |
|
[CIT]B:501 |
12 |
1 |
314 |
f |
B |
x,y,z |
1_555 |
27 |
12 |
15834 |
179.1 |
0.6 |
0.440 |
7 |
0 |
0 |
0.227 |
14 |
|
[CIT]D:401 |
12 |
1 |
315 |
f |
D |
x,y,z |
1_555 |
28 |
13 |
15811 |
176.6 |
1.3 |
0.464 |
7 |
0 |
0 |
0.227 |
| Average: |
177.8 |
1.0 |
0.452 |
7 |
0 |
0 |
0.227 |
| 9 |
15 |
|
D |
15 |
4 |
15811 |
◊ |
C |
x,y,z |
1_555 |
17 |
4 |
14874 |
158.9 |
0.4 |
0.697 |
1 |
3 |
0 |
0.000 |
| 10 |
16 |
|
C |
11 |
5 |
14874 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
14925 |
95.6 |
0.6 |
0.712 |
1 |
1 |
0 |
0.000 |
| 11 |
17 |
|
[FMN]A:401 |
9 |
1 |
602 |
◊ |
B |
x,y,z |
1_555 |
9 |
2 |
15834 |
84.4 |
0.2 |
0.726 |
0 |
0 |
0 |
0.000 |
18 |
|
[FMN]C:401 |
9 |
1 |
601 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
9 |
2 |
15811 |
84.2 |
0.2 |
0.720 |
0 |
0 |
0 |
0.000 |
| Average: |
84.3 |
0.2 |
0.723 |
0 |
0 |
0 |
0.000 |
| 12 |
19 |
|
[ACT]C:402 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
15 |
9 |
14874 |
83.8 |
0.4 |
0.721 |
2 |
0 |
0 |
0.010 |
20 |
|
[ACT]A:402 |
4 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
15 |
9 |
14925 |
82.4 |
0.5 |
0.722 |
2 |
0 |
0 |
0.010 |
| Average: |
83.1 |
0.5 |
0.722 |
2 |
0 |
0 |
0.010 |
| 13 |
21 |
|
[ACT]C:402 |
4 |
1 |
182 |
f |
[FMN]C:401 |
x,y,z |
1_555 |
13 |
1 |
601 |
53.4 |
0.8 |
0.828 |
0 |
0 |
0 |
0.000 |
22 |
|
[ACT]A:402 |
4 |
1 |
181 |
f |
[FMN]A:401 |
x,y,z |
1_555 |
14 |
1 |
602 |
53.3 |
0.8 |
0.826 |
0 |
0 |
0 |
0.000 |
| Average: |
53.3 |
0.8 |
0.827 |
0 |
0 |
0 |
0.000 |
| 14 |
23 |
|
D |
4 |
2 |
15811 |
x |
D |
x-1/2,-y+1/2,-z |
4_455 |
3 |
2 |
15811 |
45.8 |
0.1 |
0.417 |
0 |
2 |
0 |
0.000 |
| 15 |
24 |
|
D |
3 |
1 |
15811 |
◊ |
C |
x-1/2,-y-1/2,-z |
4_445 |
7 |
2 |
14874 |
45.7 |
-0.2 |
0.273 |
0 |
0 |
0 |
0.000 |
25 |
|
A |
8 |
3 |
14925 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
2 |
15834 |
44.8 |
-0.4 |
0.213 |
0 |
0 |
0 |
0.000 |
| Average: |
45.3 |
-0.3 |
0.243 |
0 |
0 |
0 |
0.000 |
| 16 |
26 |
|
[ACT]A:402 |
2 |
1 |
181 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
15834 |
16.5 |
0.2 |
0.750 |
0 |
0 |
0 |
0.000 |
27 |
|
[ACT]C:402 |
2 |
1 |
182 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
3 |
2 |
15811 |
15.6 |
0.2 |
0.759 |
0 |
0 |
0 |
0.000 |
| Average: |
16.1 |
0.2 |
0.754 |
0 |
0 |
0 |
0.000 |
| 17 |
28 |
|
C |
1 |
1 |
14874 |
◊ |
B |
x,y-1,z |
1_545 |
2 |
1 |
15834 |
7.3 |
0.2 |
0.785 |
0 |
0 |
0 |
0.000 |
| 18 |
29 |
|
[CIT]D:401 |
1 |
1 |
315 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
15834 |
5.0 |
-0.0 |
0.231 |
0 |
0 |
0 |
0.009 |
30 |
|
[CIT]B:501 |
1 |
1 |
314 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
15811 |
4.1 |
-0.2 |
0.239 |
0 |
0 |
0 |
0.009 |
| Average: |
4.5 |
-0.1 |
0.235 |
0 |
0 |
0 |
0.009 |
| 19 |
31 |
|
C |
1 |
1 |
14874 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
15834 |
4.9 |
-0.2 |
0.312 |
0 |
0 |
0 |
0.000 |
|