## |
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 |
292 |
72 |
10030 |
◊ |
A |
x,y,z |
1_555 |
285 |
72 |
10224 |
2769.6 |
-36.7 |
0.136 |
38 |
22 |
0 |
0.412 |
2 |
2 |
|
A |
56 |
20 |
10224 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
49 |
15 |
10224 |
460.0 |
-4.1 |
0.509 |
4 |
0 |
0 |
0.000 |
3 |
3 |
|
[FAD]A:209 |
28 |
1 |
602 |
f |
A |
x,y,z |
1_555 |
55 |
23 |
10224 |
373.5 |
-7.0 |
0.508 |
10 |
0 |
0 |
0.241 |
4 |
|
[FAD]B:207 |
28 |
1 |
605 |
f |
B |
x,y,z |
1_555 |
51 |
23 |
10030 |
355.5 |
-6.9 |
0.517 |
10 |
0 |
0 |
0.241 |
Average: |
364.5 |
-7.0 |
0.512 |
10 |
0 |
0 |
0.241 |
4 |
5 |
|
B |
37 |
13 |
10030 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
32 |
8 |
10030 |
288.9 |
-3.4 |
0.505 |
1 |
2 |
0 |
0.000 |
5 |
6 |
|
A |
33 |
8 |
10224 |
◊ |
B |
x-1,y,z |
1_455 |
34 |
10 |
10030 |
285.3 |
-1.4 |
0.713 |
3 |
4 |
0 |
0.035 |
6 |
7 |
|
[NAD]B:201 |
23 |
1 |
472 |
f |
B |
x,y,z |
1_555 |
31 |
10 |
10030 |
234.2 |
-2.0 |
0.608 |
4 |
0 |
0 |
0.079 |
8 |
|
[NAD]A:201 |
23 |
1 |
473 |
f |
A |
x,y,z |
1_555 |
34 |
11 |
10224 |
233.1 |
-1.9 |
0.634 |
4 |
0 |
0 |
0.079 |
Average: |
233.7 |
-2.0 |
0.621 |
4 |
0 |
0 |
0.079 |
7 |
9 |
|
[NAD]B:202 |
16 |
1 |
496 |
◊ |
B |
x,y,z |
1_555 |
24 |
10 |
10030 |
152.4 |
1.2 |
0.779 |
1 |
0 |
0 |
0.000 |
10 |
|
[NAD]A:202 |
17 |
1 |
492 |
◊ |
A |
x,y,z |
1_555 |
22 |
10 |
10224 |
149.9 |
1.5 |
0.793 |
1 |
0 |
0 |
0.000 |
Average: |
151.2 |
1.3 |
0.786 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
[FAD]B:207 |
22 |
1 |
605 |
◊ |
[NAD]B:202 |
x,y,z |
1_555 |
18 |
1 |
496 |
132.7 |
3.1 |
0.869 |
0 |
0 |
0 |
0.000 |
12 |
|
[FAD]A:209 |
22 |
1 |
602 |
◊ |
[NAD]A:202 |
x,y,z |
1_555 |
18 |
1 |
492 |
130.5 |
3.1 |
0.866 |
0 |
0 |
0 |
0.000 |
Average: |
131.6 |
3.1 |
0.868 |
0 |
0 |
0 |
0.000 |
9 |
13 |
|
[NAD]A:202 |
15 |
1 |
492 |
◊ |
[NAD]A:201 |
x,y,z |
1_555 |
14 |
1 |
473 |
115.8 |
-1.5 |
0.545 |
1 |
0 |
0 |
0.036 |
14 |
|
[NAD]B:202 |
16 |
1 |
496 |
◊ |
[NAD]B:201 |
x,y,z |
1_555 |
14 |
1 |
472 |
114.9 |
-1.0 |
0.556 |
1 |
0 |
0 |
0.036 |
Average: |
115.3 |
-1.2 |
0.550 |
1 |
0 |
0 |
0.036 |
10 |
15 |
|
[ACT]A:206 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
10224 |
101.8 |
-0.8 |
0.634 |
2 |
0 |
0 |
0.018 |
11 |
16 |
|
[ACT]B:206 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
10030 |
93.9 |
-0.6 |
0.668 |
1 |
0 |
0 |
0.011 |
12 |
17 |
|
A |
12 |
5 |
10224 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
11 |
5 |
10030 |
92.8 |
-1.5 |
0.432 |
0 |
0 |
0 |
0.000 |
13 |
18 |
|
[NAD]B:201 |
14 |
1 |
472 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
10224 |
82.7 |
0.5 |
0.601 |
0 |
0 |
0 |
0.000 |
19 |
|
[NAD]A:201 |
14 |
1 |
473 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
10030 |
82.5 |
0.5 |
0.636 |
0 |
0 |
0 |
0.000 |
Average: |
82.6 |
0.5 |
0.618 |
0 |
0 |
0 |
0.000 |
14 |
20 |
|
[ACT]A:207 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
10 |
6 |
10030 |
74.6 |
0.6 |
0.783 |
2 |
0 |
0 |
0.002 |
15 |
21 |
|
[ACT]A:207 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
10224 |
74.1 |
-0.8 |
0.632 |
0 |
0 |
0 |
0.009 |
16 |
22 |
|
[ACT]A:205 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
10224 |
72.4 |
-0.2 |
0.736 |
1 |
0 |
0 |
0.005 |
17 |
23 |
|
[ACT]A:205 |
3 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
10030 |
66.9 |
-0.8 |
0.635 |
0 |
0 |
0 |
0.009 |
18 |
24 |
|
[CL]B:205 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
10030 |
47.9 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.093 |
25 |
|
[CL]A:204 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
10224 |
46.1 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.093 |
Average: |
47.0 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.093 |
19 |
26 |
|
[MG]A:208 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
9 |
6 |
10030 |
44.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.068 |
27 |
|
[MG]A:208 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
10 |
6 |
10224 |
44.8 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.068 |
Average: |
44.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.068 |
20 |
28 |
|
[CA]B:204 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
10030 |
40.3 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.081 |
21 |
29 |
|
A |
9 |
4 |
10224 |
f |
[CL]B:205 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
39.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.100 |
30 |
|
[CL]A:204 |
1 |
1 |
125 |
f |
B |
x-1,y,z |
1_455 |
9 |
4 |
10030 |
38.8 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.100 |
Average: |
39.2 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.100 |
22 |
31 |
|
[NAD]A:202 |
4 |
1 |
492 |
f |
[CA]B:203 |
x-1,y,z |
1_455 |
1 |
1 |
85 |
28.7 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.131 |
32 |
|
[CA]A:203 |
1 |
1 |
85 |
f |
[NAD]B:202 |
x-1,y,z |
1_455 |
4 |
1 |
496 |
28.6 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.131 |
Average: |
28.6 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.131 |
23 |
33 |
|
[NAD]A:202 |
4 |
1 |
492 |
f |
B |
x-1,y,z |
1_455 |
6 |
3 |
10030 |
28.0 |
-1.0 |
0.484 |
0 |
0 |
0 |
0.020 |
34 |
|
A |
4 |
3 |
10224 |
f |
[NAD]B:202 |
x-1,y,z |
1_455 |
5 |
1 |
496 |
26.1 |
-0.9 |
0.534 |
0 |
0 |
0 |
0.020 |
Average: |
27.0 |
-1.0 |
0.509 |
0 |
0 |
0 |
0.020 |
24 |
35 |
|
[CA]A:203 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
10224 |
23.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.083 |
36 |
|
[CA]B:203 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
10030 |
22.8 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.083 |
Average: |
23.0 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.083 |
25 |
37 |
|
[ACT]A:205 |
3 |
1 |
183 |
f |
[CA]B:204 |
x,y,z |
1_555 |
1 |
1 |
85 |
21.2 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.034 |
26 |
38 |
|
[CL]A:204 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
10030 |
20.1 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.000 |
39 |
|
[CL]B:205 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
10224 |
19.5 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
19.8 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
40 |
|
[NAD]B:202 |
3 |
1 |
496 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
10224 |
14.1 |
0.3 |
0.654 |
0 |
0 |
0 |
0.000 |
41 |
|
[NAD]A:202 |
3 |
1 |
492 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
10030 |
13.9 |
0.3 |
0.660 |
0 |
0 |
0 |
0.000 |
Average: |
14.0 |
0.3 |
0.657 |
0 |
0 |
0 |
0.000 |
28 |
42 |
|
[FAD]A:209 |
5 |
1 |
602 |
f |
[NAD]A:201 |
x,y,z |
1_555 |
2 |
1 |
473 |
10.7 |
-0.4 |
0.459 |
0 |
0 |
0 |
0.007 |
43 |
|
[FAD]B:207 |
5 |
1 |
605 |
f |
[NAD]B:201 |
x,y,z |
1_555 |
2 |
1 |
472 |
10.5 |
-0.3 |
0.465 |
0 |
0 |
0 |
0.007 |
Average: |
10.6 |
-0.3 |
0.462 |
0 |
0 |
0 |
0.007 |
29 |
44 |
|
[NAD]A:201 |
2 |
1 |
473 |
◊ |
[CA]B:203 |
x-1,y,z |
1_455 |
1 |
1 |
85 |
10.4 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.031 |
45 |
|
[CA]A:203 |
1 |
1 |
85 |
◊ |
[NAD]B:201 |
x-1,y,z |
1_455 |
2 |
1 |
472 |
10.1 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.031 |
Average: |
10.2 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.031 |
30 |
46 |
|
[NAD]A:201 |
3 |
1 |
473 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
2 |
10030 |
10.2 |
0.0 |
0.590 |
0 |
0 |
0 |
0.000 |
47 |
|
A |
3 |
2 |
10224 |
◊ |
[NAD]B:201 |
x-1,y,z |
1_455 |
2 |
1 |
472 |
9.6 |
-0.0 |
0.554 |
0 |
0 |
0 |
0.000 |
Average: |
9.9 |
0.0 |
0.572 |
0 |
0 |
0 |
0.000 |
31 |
48 |
|
[CL]A:204 |
1 |
1 |
125 |
◊ |
[NAD]A:201 |
x,y,z |
1_555 |
4 |
1 |
473 |
9.4 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.014 |
49 |
|
[CL]B:205 |
1 |
1 |
125 |
◊ |
[NAD]B:201 |
x,y,z |
1_555 |
4 |
1 |
472 |
9.1 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.014 |
Average: |
9.2 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.014 |
32 |
50 |
|
[CA]A:203 |
1 |
1 |
85 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
10030 |
9.3 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.029 |
51 |
|
A |
2 |
1 |
10224 |
◊ |
[CA]B:203 |
x-1,y,z |
1_455 |
1 |
1 |
85 |
9.1 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.029 |
Average: |
9.2 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.029 |
33 |
52 |
|
[CA]B:204 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
10224 |
8.9 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.008 |
34 |
53 |
|
A |
3 |
1 |
10224 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
10224 |
6.0 |
0.1 |
0.711 |
0 |
0 |
0 |
0.000 |
35 |
54 |
|
[ACT]B:206 |
1 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
10224 |
5.4 |
-0.2 |
0.424 |
0 |
0 |
0 |
0.001 |
36 |
55 |
|
[CL]A:204 |
1 |
1 |
125 |
f |
[NAD]A:202 |
x,y,z |
1_555 |
1 |
1 |
492 |
2.8 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.008 |
56 |
|
[CL]B:205 |
1 |
1 |
125 |
f |
[NAD]B:202 |
x,y,z |
1_555 |
1 |
1 |
496 |
2.2 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.008 |
Average: |
2.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.008 |
37 |
57 |
|
[CL]A:204 |
1 |
1 |
125 |
f |
[CA]B:203 |
x-1,y,z |
1_455 |
1 |
1 |
85 |
2.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.007 |
38 |
58 |
|
[CA]A:203 |
1 |
1 |
85 |
f |
[CL]B:205 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
2.4 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.006 |
39 |
59 |
|
A |
1 |
1 |
10224 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
10030 |
2.1 |
0.1 |
0.728 |
0 |
0 |
0 |
0.000 |
|