## |
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 |
20288 |
◊ |
A |
x,y,z |
1_555 |
263 |
69 |
20150 |
2638.5 |
-40.6 |
0.003 |
38 |
9 |
0 |
0.551 |
2 |
2 |
|
A |
69 |
21 |
20150 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
71 |
20 |
20288 |
674.1 |
-0.9 |
0.701 |
12 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]B:750 |
43 |
1 |
814 |
f |
B |
x,y,z |
1_555 |
79 |
24 |
20288 |
511.5 |
-17.8 |
0.311 |
1 |
0 |
0 |
0.338 |
4 |
|
[HEM]A:750 |
43 |
1 |
814 |
f |
A |
x,y,z |
1_555 |
79 |
24 |
20150 |
510.9 |
-17.5 |
0.317 |
1 |
0 |
0 |
0.338 |
Average: |
511.2 |
-17.6 |
0.314 |
1 |
0 |
0 |
0.338 |
4 |
5 |
|
B |
48 |
14 |
20288 |
x |
B |
x-1,y,z |
1_455 |
52 |
15 |
20288 |
439.0 |
-1.1 |
0.615 |
2 |
0 |
0 |
0.000 |
5 |
6 |
|
[59W]B:800 |
24 |
1 |
629 |
f |
B |
x,y,z |
1_555 |
54 |
21 |
20288 |
330.7 |
3.9 |
0.313 |
5 |
0 |
0 |
0.000 |
7 |
|
[59W]A:800 |
24 |
1 |
621 |
f |
A |
x,y,z |
1_555 |
52 |
21 |
20150 |
327.8 |
4.1 |
0.330 |
4 |
0 |
0 |
0.000 |
Average: |
329.3 |
4.0 |
0.322 |
5 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
43 |
11 |
20288 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
32 |
9 |
20150 |
311.7 |
-0.5 |
0.664 |
4 |
2 |
0 |
0.000 |
7 |
9 |
|
[H4B]A:760 |
17 |
1 |
400 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
20150 |
197.8 |
1.9 |
0.446 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]B:760 |
17 |
1 |
401 |
f |
B |
x,y,z |
1_555 |
26 |
8 |
20288 |
194.0 |
1.8 |
0.436 |
2 |
0 |
0 |
0.000 |
Average: |
195.9 |
1.9 |
0.441 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
22 |
12 |
20150 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
22 |
9 |
20288 |
179.1 |
0.8 |
0.749 |
1 |
3 |
0 |
0.000 |
9 |
12 |
|
[59W]B:800 |
16 |
1 |
629 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
30 |
1 |
814 |
158.5 |
-1.6 |
0.413 |
2 |
0 |
0 |
0.048 |
13 |
|
[59W]A:800 |
17 |
1 |
621 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
30 |
1 |
814 |
156.4 |
-1.7 |
0.378 |
2 |
0 |
0 |
0.048 |
Average: |
157.4 |
-1.7 |
0.395 |
2 |
0 |
0 |
0.048 |
10 |
14 |
|
[H4B]B:760 |
13 |
1 |
401 |
◊ |
A |
x,y,z |
1_555 |
21 |
6 |
20150 |
119.6 |
-0.2 |
0.260 |
1 |
0 |
0 |
0.011 |
15 |
|
[H4B]A:760 |
13 |
1 |
400 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
20288 |
117.8 |
-0.1 |
0.272 |
1 |
0 |
0 |
0.011 |
Average: |
118.7 |
-0.1 |
0.266 |
1 |
0 |
0 |
0.011 |
11 |
16 |
|
[ACT]B:860 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
20288 |
114.4 |
-1.4 |
0.484 |
1 |
0 |
0 |
0.018 |
12 |
17 |
|
[ACT]A:860 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
20150 |
111.2 |
-1.4 |
0.476 |
1 |
0 |
0 |
0.017 |
13 |
18 |
|
[H4B]B:760 |
5 |
1 |
401 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
814 |
42.8 |
-1.2 |
0.426 |
1 |
0 |
0 |
0.035 |
19 |
|
[H4B]A:760 |
5 |
1 |
400 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
814 |
40.9 |
-1.2 |
0.431 |
2 |
0 |
0 |
0.035 |
Average: |
41.8 |
-1.2 |
0.428 |
2 |
0 |
0 |
0.035 |
14 |
20 |
|
B |
3 |
1 |
20288 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
7 |
4 |
20288 |
40.8 |
1.9 |
0.915 |
1 |
0 |
0 |
0.000 |
15 |
21 |
|
[59W]A:800 |
3 |
1 |
621 |
◊ |
B |
x,y,z |
1_555 |
6 |
1 |
20288 |
38.4 |
-1.2 |
0.136 |
0 |
0 |
0 |
0.023 |
22 |
|
[59W]B:800 |
2 |
1 |
629 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
20150 |
37.8 |
-1.2 |
0.136 |
0 |
0 |
0 |
0.023 |
Average: |
38.1 |
-1.2 |
0.136 |
0 |
0 |
0 |
0.023 |
16 |
23 |
|
[ACT]A:860 |
3 |
1 |
182 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
814 |
35.6 |
-1.1 |
0.753 |
0 |
0 |
0 |
0.011 |
17 |
24 |
|
[ACT]B:860 |
3 |
1 |
183 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
814 |
34.4 |
-1.1 |
0.754 |
0 |
0 |
0 |
0.010 |
18 |
25 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20150 |
34.4 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.275 |
26 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20288 |
34.3 |
-20.1 |
0.000 |
0 |
0 |
0 |
0.275 |
Average: |
34.3 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.275 |
19 |
27 |
|
A |
1 |
1 |
20150 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
20150 |
13.5 |
-0.4 |
0.175 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[59W]B:800 |
2 |
1 |
629 |
f |
[H4B]B:760 |
x,y,z |
1_555 |
3 |
1 |
401 |
12.9 |
0.2 |
0.296 |
0 |
0 |
0 |
0.000 |
29 |
|
[59W]A:800 |
2 |
1 |
621 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
3 |
1 |
400 |
12.8 |
0.2 |
0.295 |
0 |
0 |
0 |
0.000 |
Average: |
12.8 |
0.2 |
0.295 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
A |
1 |
1 |
20150 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
20150 |
5.2 |
0.1 |
0.745 |
0 |
0 |
0 |
0.000 |
22 |
31 |
|
A |
1 |
1 |
20150 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
20288 |
3.7 |
-0.0 |
0.536 |
0 |
0 |
0 |
0.000 |
|