## |
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 |
274 |
71 |
20372 |
◊ |
A |
x,y,z |
1_555 |
269 |
69 |
20176 |
2668.6 |
-38.2 |
0.010 |
40 |
10 |
0 |
0.475 |
2 |
2 |
|
A |
71 |
22 |
20176 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
72 |
21 |
20372 |
667.7 |
-0.5 |
0.745 |
9 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]A:750 |
43 |
1 |
832 |
f |
A |
x,y,z |
1_555 |
78 |
23 |
20176 |
524.5 |
-18.0 |
0.324 |
1 |
0 |
0 |
0.306 |
4 |
|
[HEM]B:750 |
43 |
1 |
832 |
f |
B |
x,y,z |
1_555 |
80 |
25 |
20372 |
521.9 |
-18.1 |
0.327 |
1 |
0 |
0 |
0.306 |
Average: |
523.2 |
-18.1 |
0.325 |
1 |
0 |
0 |
0.306 |
4 |
5 |
|
B |
48 |
14 |
20372 |
x |
B |
x-1,y,z |
1_455 |
52 |
14 |
20372 |
472.5 |
-1.0 |
0.646 |
1 |
0 |
0 |
0.000 |
5 |
6 |
|
[HW5]B:800 |
26 |
1 |
651 |
f |
B |
x,y,z |
1_555 |
50 |
20 |
20372 |
327.3 |
-1.7 |
0.329 |
3 |
0 |
0 |
0.044 |
7 |
|
[HW5]A:800 |
26 |
1 |
649 |
f |
A |
x,y,z |
1_555 |
47 |
18 |
20176 |
323.5 |
-0.9 |
0.349 |
3 |
0 |
0 |
0.044 |
Average: |
325.4 |
-1.3 |
0.339 |
3 |
0 |
0 |
0.044 |
6 |
8 |
|
B |
37 |
11 |
20372 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
32 |
9 |
20176 |
303.2 |
-2.5 |
0.446 |
2 |
1 |
0 |
0.000 |
7 |
9 |
|
[H4B]B:760 |
17 |
1 |
397 |
f |
B |
x,y,z |
1_555 |
28 |
9 |
20372 |
199.8 |
2.0 |
0.466 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]A:760 |
17 |
1 |
398 |
f |
A |
x,y,z |
1_555 |
29 |
9 |
20176 |
195.2 |
2.0 |
0.450 |
2 |
0 |
0 |
0.000 |
Average: |
197.5 |
2.0 |
0.458 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
21 |
10 |
20176 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
24 |
9 |
20372 |
185.7 |
-0.3 |
0.643 |
1 |
2 |
0 |
0.000 |
9 |
12 |
|
[HW5]B:800 |
19 |
1 |
651 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
31 |
1 |
832 |
167.7 |
-5.9 |
0.402 |
0 |
0 |
0 |
0.096 |
13 |
|
[HW5]A:800 |
17 |
1 |
649 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
31 |
1 |
832 |
162.6 |
-5.7 |
0.388 |
0 |
0 |
0 |
0.096 |
Average: |
165.1 |
-5.8 |
0.395 |
0 |
0 |
0 |
0.096 |
10 |
14 |
|
[H4B]B:760 |
13 |
1 |
397 |
◊ |
A |
x,y,z |
1_555 |
22 |
6 |
20176 |
119.4 |
-0.2 |
0.265 |
1 |
0 |
0 |
0.010 |
15 |
|
[H4B]A:760 |
13 |
1 |
398 |
◊ |
B |
x,y,z |
1_555 |
23 |
6 |
20372 |
117.5 |
-0.1 |
0.266 |
1 |
0 |
0 |
0.010 |
Average: |
118.4 |
-0.2 |
0.266 |
1 |
0 |
0 |
0.010 |
11 |
16 |
|
[ACT]B:860 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
20372 |
114.5 |
-1.4 |
0.488 |
1 |
0 |
0 |
0.015 |
12 |
17 |
|
[ACT]A:860 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
20176 |
110.5 |
-1.2 |
0.486 |
1 |
0 |
0 |
0.014 |
13 |
18 |
|
[H4B]B:760 |
5 |
1 |
397 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
832 |
40.9 |
-1.3 |
0.423 |
2 |
0 |
0 |
0.036 |
19 |
|
[H4B]A:760 |
4 |
1 |
398 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
832 |
40.6 |
-1.2 |
0.444 |
2 |
0 |
0 |
0.036 |
Average: |
40.7 |
-1.3 |
0.434 |
2 |
0 |
0 |
0.036 |
14 |
20 |
|
[HW5]B:800 |
4 |
1 |
651 |
◊ |
A |
x,y,z |
1_555 |
7 |
1 |
20176 |
39.2 |
0.3 |
0.460 |
0 |
0 |
0 |
0.000 |
21 |
|
[HW5]A:800 |
4 |
1 |
649 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
20372 |
35.8 |
0.1 |
0.296 |
0 |
0 |
0 |
0.000 |
Average: |
37.5 |
0.2 |
0.378 |
0 |
0 |
0 |
0.000 |
15 |
22 |
|
[ACT]A:860 |
3 |
1 |
183 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
832 |
37.5 |
-1.1 |
0.754 |
0 |
0 |
0 |
0.009 |
16 |
23 |
|
[ACT]B:860 |
3 |
1 |
182 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
832 |
34.8 |
-1.0 |
0.752 |
0 |
0 |
0 |
0.008 |
17 |
24 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20372 |
34.7 |
-20.1 |
0.000 |
0 |
0 |
0 |
0.252 |
25 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
20176 |
34.5 |
-20.5 |
0.000 |
0 |
0 |
0 |
0.252 |
Average: |
34.6 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.252 |
18 |
26 |
|
B |
1 |
1 |
20372 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
2 |
20372 |
23.4 |
1.3 |
0.928 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
[HW5]A:800 |
3 |
1 |
649 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
3 |
1 |
398 |
16.6 |
-0.6 |
0.225 |
0 |
0 |
0 |
0.008 |
28 |
|
[HW5]B:800 |
3 |
1 |
651 |
f |
[H4B]B:760 |
x,y,z |
1_555 |
2 |
1 |
397 |
11.5 |
-0.4 |
0.280 |
0 |
0 |
0 |
0.008 |
Average: |
14.0 |
-0.5 |
0.253 |
0 |
0 |
0 |
0.008 |
20 |
29 |
|
A |
1 |
1 |
20176 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
20372 |
3.6 |
-0.0 |
0.548 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
A |
1 |
1 |
20176 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
20176 |
1.5 |
0.0 |
0.619 |
0 |
0 |
0 |
0.000 |
|