| ## |
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 |
364 |
92 |
23896 |
◊ |
B |
x,-y+1,-z |
4_565 |
364 |
92 |
23896 |
3351.9 |
-33.8 |
0.042 |
60 |
14 |
0 |
0.477 |
2 |
|
A |
366 |
93 |
23858 |
◊ |
A |
x,-y+1,-z |
4_565 |
366 |
93 |
23858 |
3332.8 |
-35.7 |
0.028 |
58 |
14 |
0 |
0.477 |
| Average: |
3342.4 |
-34.8 |
0.035 |
59 |
14 |
0 |
0.477 |
| 2 |
3 |
|
B |
139 |
35 |
23896 |
◊ |
A |
x,y,z |
1_555 |
137 |
38 |
23858 |
1289.9 |
-7.6 |
0.459 |
19 |
6 |
0 |
0.196 |
| 3 |
4 |
|
B |
79 |
22 |
23896 |
◊ |
A |
x,-y+1,-z |
4_565 |
80 |
22 |
23858 |
840.5 |
-7.9 |
0.219 |
9 |
4 |
0 |
0.077 |
| 4 |
5 |
|
[FAD]A:1615 |
52 |
1 |
1001 |
f |
A |
x,y,z |
1_555 |
96 |
37 |
23858 |
706.4 |
-12.0 |
0.322 |
13 |
0 |
0 |
0.416 |
6 |
|
[FAD]B:1618 |
52 |
1 |
1001 |
f |
B |
x,y,z |
1_555 |
96 |
36 |
23896 |
704.0 |
-11.9 |
0.339 |
14 |
0 |
0 |
0.416 |
| Average: |
705.2 |
-12.0 |
0.330 |
14 |
0 |
0 |
0.416 |
| 5 |
7 |
|
B |
74 |
21 |
23896 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
75 |
24 |
23858 |
664.5 |
-3.4 |
0.448 |
3 |
2 |
0 |
0.000 |
| 6 |
8 |
|
B |
55 |
14 |
23896 |
◊ |
A |
x-1/2,y+1/2,z |
5_455 |
60 |
22 |
23858 |
483.2 |
1.2 |
0.823 |
4 |
1 |
0 |
0.000 |
| 7 |
9 |
|
[HTL]A:1614 |
28 |
1 |
641 |
f |
A |
x,y,z |
1_555 |
57 |
24 |
23858 |
333.8 |
-4.3 |
0.279 |
8 |
0 |
0 |
0.181 |
10 |
|
[HTL]B:1617 |
28 |
1 |
637 |
f |
B |
x,y,z |
1_555 |
55 |
23 |
23896 |
328.7 |
-4.2 |
0.283 |
8 |
0 |
0 |
0.181 |
| Average: |
331.3 |
-4.3 |
0.281 |
8 |
0 |
0 |
0.181 |
| 8 |
11 |
|
B |
31 |
10 |
23896 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
31 |
10 |
23896 |
292.7 |
0.1 |
0.723 |
6 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[HTL]A:1614 |
16 |
1 |
641 |
◊ |
A |
x,-y+1,-z |
4_565 |
25 |
12 |
23858 |
168.1 |
1.7 |
0.625 |
0 |
0 |
0 |
0.000 |
13 |
|
[HTL]B:1617 |
16 |
1 |
637 |
◊ |
B |
x,-y+1,-z |
4_565 |
23 |
11 |
23896 |
166.1 |
1.9 |
0.650 |
0 |
0 |
0 |
0.000 |
| Average: |
167.1 |
1.8 |
0.638 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
B |
24 |
6 |
23896 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
11 |
4 |
23858 |
138.3 |
-1.1 |
0.460 |
2 |
0 |
0 |
0.000 |
| 11 |
15 |
|
[PYR]A:1616 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
21 |
8 |
23858 |
134.7 |
3.0 |
0.388 |
5 |
0 |
0 |
0.000 |
16 |
|
[PYR]B:1619 |
6 |
1 |
214 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
23896 |
134.0 |
3.1 |
0.376 |
5 |
0 |
0 |
0.000 |
| Average: |
134.3 |
3.1 |
0.382 |
5 |
0 |
0 |
0.000 |
| 12 |
17 |
|
[FAD]A:1615 |
10 |
1 |
1001 |
◊ |
A |
x,-y+1,-z |
4_565 |
7 |
1 |
23858 |
58.7 |
-1.8 |
0.210 |
0 |
0 |
0 |
0.028 |
18 |
|
[FAD]B:1618 |
11 |
1 |
1001 |
◊ |
B |
x,-y+1,-z |
4_565 |
7 |
1 |
23896 |
58.6 |
-1.8 |
0.204 |
0 |
0 |
0 |
0.028 |
| Average: |
58.6 |
-1.8 |
0.207 |
0 |
0 |
0 |
0.028 |
| 13 |
19 |
|
[NA]B:1611 |
1 |
1 |
125 |
x |
B |
x,y,z |
1_555 |
9 |
6 |
23896 |
56.5 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.169 |
20 |
|
[NA]A:1613 |
1 |
1 |
125 |
x |
A |
x,y,z |
1_555 |
8 |
6 |
23858 |
53.1 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.169 |
| Average: |
54.8 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.169 |
| 14 |
21 |
|
[NA]A:1613 |
1 |
1 |
125 |
f |
[NA]A:1613 |
x,-y+1,-z |
4_565 |
1 |
1 |
125 |
50.1 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.100 |
| 15 |
22 |
|
[MG]B:1612 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
8 |
23896 |
38.7 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.138 |
23 |
|
[MG]A:1610 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
8 |
23858 |
38.5 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.138 |
| Average: |
38.6 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.138 |
| 16 |
24 |
|
[HTL]B:1617 |
4 |
1 |
637 |
f |
[MG]B:1612 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.5 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.095 |
25 |
|
[HTL]A:1614 |
4 |
1 |
641 |
f |
[MG]A:1610 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.095 |
| Average: |
30.3 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.095 |
| 17 |
26 |
|
[FAD]A:1615 |
2 |
1 |
1001 |
f |
[HTL]A:1614 |
x,y,z |
1_555 |
2 |
1 |
641 |
24.7 |
0.3 |
0.548 |
0 |
0 |
0 |
0.000 |
27 |
|
[FAD]B:1618 |
2 |
1 |
1001 |
f |
[HTL]B:1617 |
x,y,z |
1_555 |
2 |
1 |
637 |
24.7 |
0.2 |
0.554 |
0 |
0 |
0 |
0.000 |
| Average: |
24.7 |
0.3 |
0.551 |
0 |
0 |
0 |
0.000 |
|