## |
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 |
270 |
69 |
20012 |
◊ |
A |
x,y,z |
1_555 |
274 |
71 |
19887 |
2667.3 |
-38.8 |
0.008 |
29 |
10 |
0 |
0.480 |
2 |
2 |
|
A |
97 |
29 |
19887 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
95 |
29 |
20012 |
759.7 |
-3.6 |
0.631 |
9 |
8 |
0 |
0.000 |
3 |
3 |
|
[HEM]B:500 |
43 |
1 |
831 |
f |
B |
x,y,z |
1_555 |
79 |
24 |
20012 |
525.1 |
-18.0 |
0.298 |
1 |
0 |
0 |
0.333 |
4 |
|
[HEM]A:500 |
43 |
1 |
826 |
f |
A |
x,y,z |
1_555 |
79 |
24 |
19887 |
521.5 |
-18.0 |
0.313 |
1 |
0 |
0 |
0.333 |
Average: |
523.3 |
-18.0 |
0.305 |
1 |
0 |
0 |
0.333 |
4 |
5 |
|
A |
54 |
16 |
19887 |
x |
A |
-x,y-1/2,-z+1/2 |
4_545 |
52 |
15 |
19887 |
455.8 |
-2.4 |
0.568 |
3 |
2 |
0 |
0.000 |
5 |
6 |
|
[HW8]B:800 |
25 |
1 |
630 |
f |
B |
x,y,z |
1_555 |
49 |
20 |
20012 |
354.1 |
-1.9 |
0.324 |
1 |
0 |
0 |
0.039 |
7 |
|
[HW8]A:800 |
25 |
1 |
628 |
f |
A |
x,y,z |
1_555 |
45 |
20 |
19887 |
350.7 |
-1.5 |
0.344 |
1 |
0 |
0 |
0.039 |
Average: |
352.4 |
-1.7 |
0.334 |
1 |
0 |
0 |
0.039 |
6 |
8 |
|
B |
29 |
10 |
20012 |
x |
B |
x-1,y,z |
1_455 |
25 |
6 |
20012 |
281.2 |
-2.8 |
0.299 |
1 |
1 |
0 |
0.000 |
7 |
9 |
|
[H4B]B:600 |
17 |
1 |
396 |
f |
B |
x,y,z |
1_555 |
30 |
10 |
20012 |
193.7 |
2.7 |
0.519 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]A:600 |
17 |
1 |
397 |
f |
A |
x,y,z |
1_555 |
29 |
10 |
19887 |
189.1 |
2.7 |
0.515 |
2 |
0 |
0 |
0.000 |
Average: |
191.4 |
2.7 |
0.517 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
[HW8]A:800 |
20 |
1 |
628 |
f |
[HEM]A:500 |
x,y,z |
1_555 |
29 |
1 |
826 |
156.6 |
-3.9 |
0.650 |
1 |
0 |
0 |
0.083 |
12 |
|
[HW8]B:800 |
19 |
1 |
630 |
f |
[HEM]B:500 |
x,y,z |
1_555 |
28 |
1 |
831 |
155.5 |
-4.0 |
0.676 |
2 |
0 |
0 |
0.083 |
Average: |
156.0 |
-3.9 |
0.663 |
2 |
0 |
0 |
0.083 |
9 |
13 |
|
[H4B]A:600 |
13 |
1 |
397 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
20012 |
118.6 |
-0.1 |
0.269 |
1 |
0 |
0 |
0.011 |
14 |
|
[H4B]B:600 |
13 |
1 |
396 |
◊ |
A |
x,y,z |
1_555 |
24 |
6 |
19887 |
116.4 |
-0.1 |
0.277 |
1 |
0 |
0 |
0.011 |
Average: |
117.5 |
-0.1 |
0.273 |
1 |
0 |
0 |
0.011 |
10 |
15 |
|
[ACT]B:860 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
16 |
9 |
20012 |
114.2 |
-1.4 |
0.486 |
2 |
0 |
0 |
0.021 |
11 |
16 |
|
[ACT]A:860 |
4 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
19887 |
114.2 |
-1.5 |
0.489 |
2 |
0 |
0 |
0.021 |
12 |
17 |
|
B |
11 |
4 |
20012 |
◊ |
A |
-x,y-1/2,-z+1/2 |
4_545 |
7 |
3 |
19887 |
65.0 |
-0.8 |
0.437 |
0 |
0 |
0 |
0.000 |
13 |
18 |
|
A |
7 |
4 |
19887 |
◊ |
B |
-x,y-1/2,-z+1/2 |
4_545 |
5 |
2 |
20012 |
46.2 |
-0.6 |
0.407 |
0 |
0 |
0 |
0.000 |
14 |
19 |
|
[H4B]A:600 |
4 |
1 |
397 |
f |
[HEM]A:500 |
x,y,z |
1_555 |
5 |
1 |
826 |
41.3 |
-1.3 |
0.442 |
1 |
0 |
0 |
0.030 |
20 |
|
[H4B]B:600 |
4 |
1 |
396 |
f |
[HEM]B:500 |
x,y,z |
1_555 |
5 |
1 |
831 |
40.5 |
-1.2 |
0.459 |
1 |
0 |
0 |
0.030 |
Average: |
40.9 |
-1.2 |
0.451 |
1 |
0 |
0 |
0.030 |
15 |
21 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20012 |
34.5 |
-20.5 |
0.000 |
0 |
0 |
0 |
0.268 |
22 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
19887 |
34.3 |
-20.1 |
0.000 |
0 |
0 |
0 |
0.268 |
Average: |
34.4 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.268 |
16 |
23 |
|
[ACT]B:860 |
2 |
1 |
182 |
f |
[HEM]B:500 |
x,y,z |
1_555 |
5 |
1 |
831 |
33.5 |
-1.0 |
0.692 |
0 |
0 |
0 |
0.009 |
17 |
24 |
|
[ACT]A:860 |
2 |
1 |
181 |
f |
[HEM]A:500 |
x,y,z |
1_555 |
5 |
1 |
826 |
31.7 |
-0.9 |
0.696 |
0 |
0 |
0 |
0.008 |
18 |
25 |
|
[HW8]A:800 |
2 |
1 |
628 |
f |
[H4B]A:600 |
x,y,z |
1_555 |
3 |
1 |
397 |
22.8 |
0.1 |
0.255 |
0 |
0 |
0 |
0.000 |
26 |
|
[HW8]B:800 |
2 |
1 |
630 |
f |
[H4B]B:600 |
x,y,z |
1_555 |
3 |
1 |
396 |
20.9 |
0.2 |
0.273 |
0 |
0 |
0 |
0.000 |
Average: |
21.9 |
0.1 |
0.264 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
A |
3 |
1 |
19887 |
x |
A |
-x+1,y-1/2,-z+1/2 |
4_645 |
2 |
2 |
19887 |
18.8 |
0.3 |
0.780 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
B |
5 |
1 |
20012 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
1 |
19887 |
11.8 |
0.3 |
0.742 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[HW8]B:800 |
1 |
1 |
630 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
19887 |
2.1 |
-0.1 |
0.489 |
0 |
0 |
0 |
0.000 |
|