| ## |
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 |
263 |
69 |
20106 |
◊ |
A |
x,y,z |
1_555 |
268 |
68 |
20145 |
2583.9 |
-39.2 |
0.005 |
40 |
9 |
0 |
0.458 |
| 2 |
2 |
|
A |
71 |
19 |
20145 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
69 |
19 |
20106 |
674.3 |
-1.4 |
0.682 |
9 |
0 |
0 |
0.000 |
| 3 |
3 |
|
[HEM]B:801 |
41 |
1 |
823 |
f |
B |
x,y,z |
1_555 |
79 |
23 |
20106 |
508.3 |
-17.7 |
0.320 |
2 |
0 |
0 |
0.291 |
4 |
|
[HEM]A:801 |
40 |
1 |
827 |
f |
A |
x,y,z |
1_555 |
78 |
22 |
20145 |
503.8 |
-17.6 |
0.312 |
2 |
0 |
0 |
0.291 |
| Average: |
506.0 |
-17.6 |
0.316 |
2 |
0 |
0 |
0.291 |
| 4 |
5 |
|
B |
53 |
14 |
20106 |
x |
B |
x-1,y,z |
1_455 |
58 |
15 |
20106 |
479.8 |
2.3 |
0.821 |
5 |
0 |
0 |
0.000 |
| 5 |
6 |
|
[8FD]B:803 |
26 |
1 |
631 |
f |
B |
x,y,z |
1_555 |
46 |
17 |
20106 |
338.7 |
-3.2 |
0.576 |
3 |
0 |
0 |
0.074 |
7 |
|
[8FD]A:803 |
26 |
1 |
635 |
f |
A |
x,y,z |
1_555 |
49 |
19 |
20145 |
337.2 |
-3.5 |
0.562 |
3 |
0 |
0 |
0.074 |
| Average: |
337.9 |
-3.4 |
0.569 |
3 |
0 |
0 |
0.074 |
| 6 |
8 |
|
B |
37 |
11 |
20106 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
30 |
8 |
20145 |
280.7 |
-2.5 |
0.436 |
2 |
1 |
0 |
0.000 |
| 7 |
9 |
|
[H4B]B:802 |
17 |
1 |
396 |
f |
B |
x,y,z |
1_555 |
29 |
8 |
20106 |
184.8 |
2.1 |
0.499 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]A:802 |
17 |
1 |
394 |
f |
A |
x,y,z |
1_555 |
27 |
9 |
20145 |
179.1 |
2.1 |
0.499 |
2 |
0 |
0 |
0.000 |
| Average: |
182.0 |
2.1 |
0.499 |
2 |
0 |
0 |
0.000 |
| 8 |
11 |
|
[8FD]A:803 |
23 |
1 |
635 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
39 |
1 |
827 |
181.9 |
-6.4 |
0.857 |
0 |
0 |
0 |
0.099 |
12 |
|
[8FD]B:803 |
23 |
1 |
631 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
39 |
1 |
823 |
177.9 |
-6.2 |
0.864 |
0 |
0 |
0 |
0.099 |
| Average: |
179.9 |
-6.3 |
0.861 |
0 |
0 |
0 |
0.099 |
| 9 |
13 |
|
A |
21 |
9 |
20145 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
19 |
6 |
20106 |
137.0 |
1.3 |
0.801 |
1 |
2 |
0 |
0.000 |
| 10 |
14 |
|
[H4B]B:802 |
14 |
1 |
396 |
◊ |
A |
x,y,z |
1_555 |
22 |
6 |
20145 |
116.9 |
-0.2 |
0.246 |
1 |
0 |
0 |
0.010 |
15 |
|
[H4B]A:802 |
14 |
1 |
394 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
20106 |
116.4 |
-0.2 |
0.232 |
1 |
0 |
0 |
0.010 |
| Average: |
116.7 |
-0.2 |
0.239 |
1 |
0 |
0 |
0.010 |
| 11 |
16 |
|
[ACT]A:804 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
20145 |
113.9 |
-1.4 |
0.445 |
1 |
0 |
0 |
0.015 |
| 12 |
17 |
|
[ACT]B:804 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
20106 |
113.2 |
-1.2 |
0.502 |
1 |
0 |
0 |
0.013 |
| 13 |
18 |
|
[H4B]A:802 |
5 |
1 |
394 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
6 |
1 |
827 |
41.7 |
-0.8 |
0.506 |
2 |
0 |
0 |
0.028 |
19 |
|
[H4B]B:802 |
5 |
1 |
396 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
6 |
1 |
823 |
41.1 |
-1.0 |
0.474 |
2 |
0 |
0 |
0.028 |
| Average: |
41.4 |
-0.9 |
0.490 |
2 |
0 |
0 |
0.028 |
| 14 |
20 |
|
[ACT]A:804 |
2 |
1 |
182 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
5 |
1 |
827 |
35.6 |
-1.1 |
0.694 |
0 |
0 |
0 |
0.009 |
| 15 |
21 |
|
[ACT]B:804 |
3 |
1 |
183 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
5 |
1 |
823 |
35.2 |
-1.0 |
0.751 |
0 |
0 |
0 |
0.008 |
| 16 |
22 |
|
[ZN]B:805 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20106 |
34.8 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.242 |
23 |
|
[ZN]B:805 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20145 |
34.6 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.242 |
| Average: |
34.7 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.242 |
| 17 |
24 |
|
[8FD]A:803 |
3 |
1 |
635 |
f |
[H4B]A:802 |
x,y,z |
1_555 |
3 |
1 |
394 |
33.4 |
-0.5 |
0.245 |
1 |
0 |
0 |
0.014 |
25 |
|
[8FD]B:803 |
3 |
1 |
631 |
f |
[H4B]B:802 |
x,y,z |
1_555 |
3 |
1 |
396 |
29.3 |
-0.5 |
0.228 |
1 |
0 |
0 |
0.014 |
| Average: |
31.4 |
-0.5 |
0.237 |
1 |
0 |
0 |
0.014 |
| 18 |
26 |
|
B |
3 |
2 |
20106 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
4 |
3 |
20106 |
19.8 |
0.9 |
0.851 |
0 |
0 |
0 |
0.000 |
| 19 |
27 |
|
A |
4 |
3 |
20145 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
20106 |
19.0 |
-0.0 |
0.523 |
0 |
0 |
0 |
0.000 |
|