## |
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 |
268 |
68 |
20187 |
◊ |
A |
x,y,z |
1_555 |
270 |
69 |
20053 |
2622.4 |
-37.2 |
0.011 |
39 |
9 |
0 |
0.464 |
2 |
2 |
|
A |
66 |
19 |
20053 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
66 |
18 |
20187 |
655.3 |
-0.4 |
0.745 |
14 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]B:750 |
42 |
1 |
822 |
f |
B |
x,y,z |
1_555 |
77 |
24 |
20187 |
534.3 |
-18.8 |
0.283 |
1 |
0 |
0 |
0.317 |
4 |
|
[HEM]A:750 |
42 |
1 |
822 |
f |
A |
x,y,z |
1_555 |
76 |
24 |
20053 |
531.5 |
-18.5 |
0.287 |
1 |
0 |
0 |
0.317 |
Average: |
532.9 |
-18.6 |
0.285 |
1 |
0 |
0 |
0.317 |
4 |
5 |
|
B |
53 |
15 |
20187 |
x |
B |
x-1,y,z |
1_455 |
53 |
15 |
20187 |
476.1 |
0.2 |
0.699 |
4 |
0 |
0 |
0.000 |
5 |
6 |
|
[H65]B:800 |
22 |
1 |
557 |
f |
B |
x,y,z |
1_555 |
49 |
20 |
20187 |
320.8 |
-2.7 |
0.771 |
4 |
0 |
0 |
0.073 |
7 |
|
[H65]A:800 |
22 |
1 |
557 |
f |
A |
x,y,z |
1_555 |
51 |
21 |
20053 |
319.4 |
-2.6 |
0.778 |
4 |
0 |
0 |
0.073 |
Average: |
320.1 |
-2.6 |
0.775 |
4 |
0 |
0 |
0.073 |
6 |
8 |
|
B |
38 |
11 |
20187 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
38 |
11 |
20053 |
316.1 |
-1.5 |
0.560 |
1 |
1 |
0 |
0.000 |
7 |
9 |
|
A |
33 |
12 |
20053 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
23 |
8 |
20187 |
211.2 |
1.3 |
0.765 |
2 |
2 |
0 |
0.000 |
8 |
10 |
|
[H4B]A:760 |
17 |
1 |
399 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
20053 |
201.9 |
1.9 |
0.457 |
2 |
0 |
0 |
0.000 |
11 |
|
[H4B]B:760 |
17 |
1 |
396 |
f |
B |
x,y,z |
1_555 |
28 |
9 |
20187 |
199.7 |
2.1 |
0.488 |
2 |
0 |
0 |
0.000 |
Average: |
200.8 |
2.0 |
0.472 |
2 |
0 |
0 |
0.000 |
9 |
12 |
|
[H65]B:800 |
14 |
1 |
557 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
31 |
1 |
822 |
135.8 |
-4.1 |
0.949 |
0 |
0 |
0 |
0.066 |
13 |
|
[H65]A:800 |
14 |
1 |
557 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
31 |
1 |
822 |
135.6 |
-3.9 |
0.948 |
0 |
0 |
0 |
0.066 |
Average: |
135.7 |
-4.0 |
0.948 |
0 |
0 |
0 |
0.066 |
10 |
14 |
|
[H4B]A:760 |
13 |
1 |
399 |
◊ |
B |
x,y,z |
1_555 |
21 |
6 |
20187 |
117.7 |
-0.1 |
0.269 |
1 |
0 |
0 |
0.009 |
15 |
|
[H4B]B:760 |
13 |
1 |
396 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
20053 |
117.2 |
-0.1 |
0.262 |
1 |
0 |
0 |
0.009 |
Average: |
117.4 |
-0.1 |
0.265 |
1 |
0 |
0 |
0.009 |
11 |
16 |
|
[ACT]B:860 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
20187 |
114.7 |
-1.4 |
0.488 |
1 |
0 |
0 |
0.015 |
12 |
17 |
|
[ACT]A:860 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
20053 |
111.1 |
-1.2 |
0.502 |
1 |
0 |
0 |
0.014 |
13 |
18 |
|
[H4B]A:760 |
4 |
1 |
399 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
822 |
42.4 |
-1.1 |
0.474 |
2 |
0 |
0 |
0.034 |
19 |
|
[H4B]B:760 |
4 |
1 |
396 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
822 |
40.9 |
-1.1 |
0.469 |
2 |
0 |
0 |
0.034 |
Average: |
41.6 |
-1.1 |
0.471 |
2 |
0 |
0 |
0.034 |
14 |
20 |
|
[ACT]A:860 |
3 |
1 |
182 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
822 |
37.9 |
-1.2 |
0.749 |
0 |
0 |
0 |
0.010 |
15 |
21 |
|
[ACT]B:860 |
3 |
1 |
182 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
822 |
35.7 |
-1.1 |
0.752 |
0 |
0 |
0 |
0.009 |
16 |
22 |
|
[ZN]A:1717 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20053 |
34.2 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.252 |
23 |
|
[ZN]A:1717 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20187 |
34.1 |
-20.1 |
0.000 |
0 |
0 |
0 |
0.252 |
Average: |
34.2 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.252 |
17 |
24 |
|
B |
2 |
1 |
20187 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
4 |
3 |
20187 |
26.3 |
1.0 |
0.876 |
0 |
0 |
0 |
0.000 |
18 |
25 |
|
[H65]B:800 |
3 |
1 |
557 |
f |
[H4B]B:760 |
x,y,z |
1_555 |
1 |
1 |
396 |
15.8 |
-0.6 |
0.294 |
0 |
0 |
0 |
0.008 |
26 |
|
[H65]A:800 |
3 |
1 |
557 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
1 |
1 |
399 |
12.2 |
-0.4 |
0.301 |
0 |
0 |
0 |
0.008 |
Average: |
14.0 |
-0.5 |
0.298 |
0 |
0 |
0 |
0.008 |
19 |
27 |
|
A |
2 |
1 |
20053 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
20053 |
10.8 |
-0.3 |
0.272 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
A |
3 |
2 |
20053 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
2 |
20187 |
9.3 |
-0.0 |
0.521 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
A |
2 |
1 |
20053 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
20053 |
6.8 |
-0.1 |
0.441 |
0 |
0 |
0 |
0.000 |
|