| ## |
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 |
|
A |
343 |
87 |
21022 |
◊ |
A |
-x+y+1,y,-z+1/2 |
11_655 |
341 |
87 |
21022 |
3228.7 |
-42.9 |
0.017 |
53 |
18 |
1 |
0.557 |
2 |
|
B |
334 |
88 |
20780 |
◊ |
B |
-x+2,-x+y+1,-z+5/3 |
9_766 |
331 |
88 |
20780 |
3172.0 |
-41.6 |
0.019 |
53 |
14 |
1 |
0.557 |
| Average: |
3200.3 |
-42.2 |
0.018 |
53 |
16 |
1 |
0.557 |
| 2 |
3 |
|
[HEM]B:901 |
42 |
1 |
813 |
f |
B |
x,y,z |
1_555 |
86 |
25 |
20780 |
561.6 |
-19.9 |
0.311 |
1 |
0 |
0 |
0.319 |
4 |
|
[HEM]A:901 |
41 |
1 |
808 |
f |
A |
x,y,z |
1_555 |
84 |
25 |
21022 |
561.5 |
-20.2 |
0.296 |
1 |
0 |
0 |
0.319 |
| Average: |
561.5 |
-20.0 |
0.304 |
1 |
0 |
0 |
0.319 |
| 3 |
5 |
|
B |
49 |
13 |
20780 |
◊ |
B |
-x+y+1,y,-z+3/2 |
11_656 |
49 |
13 |
20780 |
459.2 |
-3.4 |
0.450 |
4 |
0 |
0 |
0.000 |
6 |
|
A |
49 |
13 |
21022 |
◊ |
A |
-x+2,-x+y+1,-z+2/3 |
9_765 |
49 |
13 |
21022 |
433.1 |
-4.6 |
0.346 |
6 |
0 |
0 |
0.000 |
| Average: |
446.2 |
-4.0 |
0.398 |
5 |
0 |
0 |
0.000 |
| 4 |
7 |
|
B |
35 |
10 |
20780 |
◊ |
A |
x,x-y,-z+7/6 |
12_556 |
33 |
9 |
21022 |
268.1 |
-3.1 |
0.379 |
2 |
0 |
0 |
0.000 |
| 5 |
8 |
|
[H4B]B:902 |
17 |
1 |
394 |
f |
B |
x,y,z |
1_555 |
34 |
11 |
20780 |
225.3 |
2.2 |
0.456 |
3 |
0 |
0 |
0.000 |
9 |
|
[H4B]A:902 |
17 |
1 |
398 |
f |
A |
x,y,z |
1_555 |
33 |
11 |
21022 |
217.6 |
2.2 |
0.456 |
3 |
0 |
0 |
0.000 |
| Average: |
221.5 |
2.2 |
0.456 |
3 |
0 |
0 |
0.000 |
| 6 |
10 |
|
B |
30 |
10 |
20780 |
◊ |
A |
x,y,z |
1_555 |
30 |
9 |
21022 |
219.5 |
-2.4 |
0.423 |
0 |
0 |
0 |
0.000 |
| 7 |
11 |
|
[SCI]A:906 |
12 |
1 |
368 |
f |
A |
x,y,z |
1_555 |
39 |
17 |
21022 |
206.6 |
-0.4 |
0.644 |
7 |
0 |
0 |
0.051 |
12 |
|
[SCI]B:906 |
12 |
1 |
368 |
f |
B |
x,y,z |
1_555 |
38 |
17 |
20780 |
205.6 |
-0.1 |
0.642 |
7 |
0 |
0 |
0.051 |
| Average: |
206.1 |
-0.2 |
0.643 |
7 |
0 |
0 |
0.051 |
| 8 |
13 |
|
[H4B]A:902 |
13 |
1 |
398 |
◊ |
A |
-x+y+1,y,-z+1/2 |
11_655 |
21 |
5 |
21022 |
111.5 |
-0.1 |
0.257 |
1 |
0 |
0 |
0.008 |
14 |
|
[H4B]B:902 |
13 |
1 |
394 |
◊ |
B |
-x+2,-x+y+1,-z+5/3 |
9_766 |
21 |
5 |
20780 |
110.2 |
-0.1 |
0.265 |
1 |
0 |
0 |
0.008 |
| Average: |
110.8 |
-0.1 |
0.261 |
1 |
0 |
0 |
0.008 |
| 9 |
15 |
|
[SCI]B:906 |
8 |
1 |
368 |
f |
[HEM]B:901 |
x,y,z |
1_555 |
25 |
1 |
813 |
105.3 |
-2.8 |
0.681 |
1 |
0 |
0 |
0.051 |
16 |
|
[SCI]A:906 |
8 |
1 |
368 |
f |
[HEM]A:901 |
x,y,z |
1_555 |
26 |
1 |
808 |
102.8 |
-2.5 |
0.722 |
1 |
0 |
0 |
0.051 |
| Average: |
104.1 |
-2.7 |
0.702 |
1 |
0 |
0 |
0.051 |
| 10 |
17 |
|
[SO4]A:907 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
21022 |
78.3 |
-12.4 |
0.408 |
2 |
0 |
0 |
0.155 |
| 11 |
18 |
|
A |
9 |
5 |
21022 |
◊ |
B |
x,y,z-1 |
1_554 |
10 |
6 |
20780 |
65.3 |
2.1 |
0.910 |
2 |
0 |
0 |
0.000 |
| 12 |
19 |
|
[SO4]A:907 |
4 |
1 |
186 |
◊ |
A |
-x+y+1,y,-z+1/2 |
11_655 |
4 |
2 |
21022 |
49.9 |
-6.8 |
0.831 |
1 |
0 |
0 |
0.085 |
| 13 |
20 |
|
[H4B]A:902 |
5 |
1 |
398 |
f |
[HEM]A:901 |
x,y,z |
1_555 |
5 |
1 |
808 |
41.0 |
-1.3 |
0.428 |
2 |
0 |
0 |
0.028 |
21 |
|
[H4B]B:902 |
4 |
1 |
394 |
f |
[HEM]B:901 |
x,y,z |
1_555 |
5 |
1 |
813 |
39.4 |
-1.3 |
0.451 |
1 |
0 |
0 |
0.028 |
| Average: |
40.2 |
-1.3 |
0.439 |
2 |
0 |
0 |
0.028 |
| 14 |
22 |
|
A |
2 |
2 |
21022 |
◊ |
A |
x,x-y,-z+1/6 |
12_555 |
2 |
2 |
21022 |
25.7 |
-0.8 |
0.155 |
0 |
0 |
0 |
0.000 |
|