## |
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 |
399 |
102 |
22245 |
◊ |
A |
x,y,z |
1_555 |
408 |
104 |
22488 |
3779.9 |
-36.0 |
0.156 |
65 |
27 |
0 |
0.634 |
2 |
|
D |
396 |
105 |
22393 |
◊ |
C |
x,y,z |
1_555 |
404 |
106 |
22594 |
3768.0 |
-35.7 |
0.146 |
66 |
26 |
0 |
0.634 |
Average: |
3774.0 |
-35.9 |
0.151 |
66 |
27 |
0 |
0.634 |
2 |
3 |
|
D |
83 |
25 |
22393 |
◊ |
A |
x,y,z |
1_555 |
82 |
23 |
22488 |
800.0 |
4.0 |
0.951 |
10 |
10 |
0 |
0.000 |
4 |
|
C |
79 |
23 |
22594 |
◊ |
B |
x,y,z |
1_555 |
78 |
22 |
22245 |
760.7 |
3.8 |
0.951 |
7 |
8 |
0 |
0.000 |
Average: |
780.4 |
3.9 |
0.951 |
9 |
9 |
0 |
0.000 |
3 |
5 |
|
[FAD]B:600 |
46 |
1 |
985 |
f |
B |
x,y,z |
1_555 |
66 |
26 |
22245 |
535.8 |
-5.8 |
0.487 |
15 |
0 |
0 |
0.231 |
6 |
|
[FAD]D:600 |
46 |
1 |
990 |
f |
D |
x,y,z |
1_555 |
69 |
27 |
22393 |
535.1 |
-6.1 |
0.482 |
16 |
0 |
0 |
0.231 |
7 |
|
[FAD]A:600 |
46 |
1 |
981 |
f |
A |
x,y,z |
1_555 |
68 |
27 |
22488 |
530.4 |
-5.7 |
0.497 |
15 |
0 |
0 |
0.231 |
8 |
|
[FAD]C:600 |
47 |
1 |
983 |
f |
C |
x,y,z |
1_555 |
68 |
26 |
22594 |
529.3 |
-5.3 |
0.515 |
15 |
0 |
0 |
0.231 |
Average: |
532.7 |
-5.7 |
0.495 |
15 |
0 |
0 |
0.231 |
4 |
9 |
|
C |
45 |
13 |
22594 |
◊ |
A |
x,y,z |
1_555 |
47 |
14 |
22488 |
400.8 |
3.8 |
0.944 |
6 |
0 |
0 |
0.000 |
10 |
|
D |
44 |
13 |
22393 |
◊ |
B |
x,y,z |
1_555 |
46 |
13 |
22245 |
395.8 |
3.6 |
0.948 |
6 |
0 |
0 |
0.000 |
Average: |
398.3 |
3.7 |
0.946 |
6 |
0 |
0 |
0.000 |
5 |
11 |
|
[FAD]C:600 |
33 |
1 |
983 |
◊ |
D |
x,y,z |
1_555 |
45 |
16 |
22393 |
338.1 |
-5.0 |
0.424 |
3 |
0 |
0 |
0.116 |
12 |
|
[FAD]A:600 |
32 |
1 |
981 |
◊ |
B |
x,y,z |
1_555 |
44 |
16 |
22245 |
337.5 |
-4.9 |
0.430 |
3 |
0 |
0 |
0.116 |
13 |
|
[FAD]D:600 |
31 |
1 |
990 |
◊ |
C |
x,y,z |
1_555 |
45 |
16 |
22594 |
337.2 |
-4.9 |
0.424 |
3 |
0 |
0 |
0.116 |
14 |
|
[FAD]B:600 |
32 |
1 |
985 |
◊ |
A |
x,y,z |
1_555 |
42 |
16 |
22488 |
335.5 |
-5.0 |
0.411 |
3 |
0 |
0 |
0.116 |
Average: |
337.1 |
-5.0 |
0.422 |
3 |
0 |
0 |
0.116 |
6 |
15 |
|
A |
33 |
10 |
22488 |
◊ |
C |
-x+1,y-1/2,-z-1/2 |
3_644 |
31 |
10 |
22594 |
299.7 |
0.9 |
0.785 |
4 |
2 |
0 |
0.000 |
7 |
16 |
|
D |
24 |
8 |
22393 |
◊ |
C |
-x+1,y-1/2,-z-1/2 |
3_644 |
30 |
10 |
22594 |
288.1 |
-0.5 |
0.596 |
3 |
2 |
0 |
0.000 |
8 |
17 |
|
B |
33 |
12 |
22245 |
◊ |
D |
x-1,y,z |
1_455 |
30 |
11 |
22393 |
287.2 |
3.3 |
0.927 |
6 |
3 |
0 |
0.000 |
9 |
18 |
|
A |
24 |
7 |
22488 |
◊ |
D |
x-1,y,z |
1_455 |
23 |
7 |
22393 |
199.1 |
-0.2 |
0.685 |
0 |
0 |
0 |
0.000 |
10 |
19 |
|
[MRD]D:601 |
7 |
1 |
275 |
f |
D |
x,y,z |
1_555 |
38 |
13 |
22393 |
195.1 |
2.6 |
0.532 |
1 |
0 |
0 |
0.000 |
11 |
20 |
|
[MRD]A:601 |
7 |
1 |
277 |
f |
A |
x,y,z |
1_555 |
39 |
15 |
22488 |
193.4 |
2.6 |
0.569 |
1 |
0 |
0 |
0.000 |
21 |
|
[MRD]B:601 |
7 |
1 |
275 |
f |
B |
x,y,z |
1_555 |
38 |
13 |
22245 |
192.6 |
2.7 |
0.586 |
1 |
0 |
0 |
0.000 |
22 |
|
[MRD]C:601 |
7 |
1 |
276 |
f |
C |
x,y,z |
1_555 |
35 |
15 |
22594 |
192.1 |
2.6 |
0.499 |
1 |
0 |
0 |
0.000 |
Average: |
192.7 |
2.6 |
0.551 |
1 |
0 |
0 |
0.000 |
12 |
23 |
|
[MPD]D:602 |
7 |
1 |
275 |
f |
D |
x,y,z |
1_555 |
31 |
9 |
22393 |
162.6 |
-10.9 |
0.665 |
0 |
0 |
0 |
0.202 |
24 |
|
[MPD]C:602 |
7 |
1 |
277 |
f |
C |
x,y,z |
1_555 |
31 |
10 |
22594 |
160.4 |
-10.7 |
0.662 |
1 |
0 |
0 |
0.202 |
Average: |
161.5 |
-10.8 |
0.663 |
1 |
0 |
0 |
0.202 |
13 |
25 |
|
[MPD]A:602 |
7 |
1 |
276 |
f |
A |
x,y,z |
1_555 |
30 |
9 |
22488 |
159.7 |
-10.4 |
0.675 |
1 |
0 |
0 |
0.098 |
14 |
26 |
|
[MPD]B:602 |
7 |
1 |
275 |
f |
B |
x,y,z |
1_555 |
30 |
9 |
22245 |
156.9 |
-10.1 |
0.709 |
1 |
0 |
0 |
0.095 |
15 |
27 |
|
[CAC]C:604 |
5 |
1 |
237 |
f |
C |
x,y,z |
1_555 |
23 |
6 |
22594 |
142.9 |
4.0 |
0.389 |
0 |
0 |
0 |
0.000 |
16 |
28 |
|
[CAC]D:604 |
5 |
1 |
236 |
f |
D |
x,y,z |
1_555 |
23 |
6 |
22393 |
141.9 |
3.8 |
0.381 |
0 |
0 |
0 |
0.000 |
17 |
29 |
|
[CAC]B:604 |
5 |
1 |
237 |
f |
B |
x,y,z |
1_555 |
23 |
6 |
22245 |
141.5 |
4.2 |
0.442 |
0 |
0 |
0 |
0.000 |
18 |
30 |
|
C |
19 |
8 |
22594 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
25 |
9 |
22245 |
140.9 |
0.8 |
0.778 |
1 |
2 |
0 |
0.000 |
19 |
31 |
|
[CAC]A:603 |
5 |
1 |
237 |
f |
A |
x,y,z |
1_555 |
24 |
9 |
22488 |
139.5 |
4.1 |
0.450 |
0 |
0 |
0 |
0.000 |
20 |
32 |
|
[CAC]B:603 |
5 |
1 |
237 |
f |
B |
x,y,z |
1_555 |
26 |
9 |
22245 |
139.5 |
3.8 |
0.414 |
0 |
0 |
0 |
0.000 |
21 |
33 |
|
[CAC]C:603 |
5 |
1 |
237 |
f |
C |
x,y,z |
1_555 |
23 |
9 |
22594 |
135.8 |
4.1 |
0.430 |
0 |
0 |
0 |
0.000 |
22 |
34 |
|
[CAC]D:603 |
4 |
1 |
222 |
f |
D |
x,y,z |
1_555 |
24 |
9 |
22393 |
132.5 |
3.6 |
0.564 |
0 |
0 |
0 |
0.000 |
23 |
35 |
|
A |
17 |
7 |
22488 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
13 |
4 |
22393 |
129.7 |
2.8 |
0.917 |
1 |
0 |
0 |
0.000 |
24 |
36 |
|
D |
14 |
3 |
22393 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
12 |
4 |
22245 |
114.7 |
-0.5 |
0.520 |
0 |
2 |
0 |
0.000 |
25 |
37 |
|
A |
9 |
3 |
22488 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
8 |
3 |
22488 |
69.2 |
1.2 |
0.843 |
1 |
1 |
0 |
0.000 |
26 |
38 |
|
[MRD]C:601 |
1 |
1 |
276 |
f |
[FAD]C:600 |
x,y,z |
1_555 |
1 |
1 |
983 |
2.7 |
0.0 |
0.409 |
0 |
0 |
0 |
0.000 |
39 |
|
[MRD]B:601 |
1 |
1 |
275 |
f |
[FAD]B:600 |
x,y,z |
1_555 |
1 |
1 |
985 |
2.0 |
0.0 |
0.399 |
0 |
0 |
0 |
0.000 |
40 |
|
[MRD]A:601 |
1 |
1 |
277 |
f |
[FAD]A:600 |
x,y,z |
1_555 |
1 |
1 |
981 |
0.7 |
0.0 |
0.392 |
0 |
0 |
0 |
0.000 |
Average: |
1.8 |
0.0 |
0.400 |
0 |
0 |
0 |
0.000 |
|