## |
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 |
269 |
70 |
20139 |
◊ |
A |
x,y,z |
1_555 |
259 |
68 |
19959 |
2607.6 |
-40.1 |
0.004 |
40 |
9 |
0 |
0.498 |
2 |
2 |
|
A |
73 |
19 |
19959 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
69 |
19 |
20139 |
675.4 |
-1.3 |
0.699 |
8 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]A:750 |
42 |
1 |
816 |
f |
A |
x,y,z |
1_555 |
76 |
24 |
19959 |
532.3 |
-18.2 |
0.287 |
1 |
0 |
0 |
0.313 |
4 |
|
[HEM]B:750 |
43 |
1 |
814 |
f |
B |
x,y,z |
1_555 |
79 |
24 |
20139 |
530.9 |
-18.1 |
0.328 |
1 |
0 |
0 |
0.313 |
Average: |
531.6 |
-18.2 |
0.307 |
1 |
0 |
0 |
0.313 |
4 |
5 |
|
B |
51 |
15 |
20139 |
x |
B |
x-1,y,z |
1_455 |
53 |
15 |
20139 |
495.3 |
1.5 |
0.781 |
5 |
0 |
0 |
0.000 |
5 |
6 |
|
[7F5]A:800 |
25 |
1 |
605 |
f |
A |
x,y,z |
1_555 |
45 |
17 |
19959 |
320.6 |
-2.4 |
0.309 |
1 |
0 |
0 |
0.047 |
7 |
|
[7F5]B:800 |
24 |
1 |
604 |
f |
B |
x,y,z |
1_555 |
45 |
17 |
20139 |
317.7 |
-2.2 |
0.325 |
1 |
0 |
0 |
0.047 |
Average: |
319.2 |
-2.3 |
0.317 |
1 |
0 |
0 |
0.047 |
6 |
8 |
|
B |
39 |
10 |
20139 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
31 |
8 |
19959 |
276.2 |
-1.7 |
0.548 |
2 |
1 |
0 |
0.000 |
7 |
9 |
|
[H4B]A:760 |
17 |
1 |
398 |
f |
A |
x,y,z |
1_555 |
29 |
9 |
19959 |
194.0 |
2.2 |
0.480 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]B:760 |
17 |
1 |
395 |
f |
B |
x,y,z |
1_555 |
26 |
7 |
20139 |
190.3 |
1.8 |
0.422 |
2 |
0 |
0 |
0.000 |
Average: |
192.1 |
2.0 |
0.451 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
21 |
10 |
19959 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
22 |
6 |
20139 |
175.2 |
1.0 |
0.755 |
3 |
3 |
0 |
0.000 |
9 |
12 |
|
[7F5]B:800 |
13 |
1 |
604 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
26 |
1 |
814 |
136.5 |
-4.8 |
0.576 |
2 |
0 |
0 |
0.092 |
13 |
|
[7F5]A:800 |
13 |
1 |
605 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
26 |
1 |
816 |
134.7 |
-4.7 |
0.576 |
1 |
0 |
0 |
0.092 |
Average: |
135.6 |
-4.8 |
0.576 |
2 |
0 |
0 |
0.092 |
10 |
14 |
|
[H4B]B:760 |
13 |
1 |
395 |
◊ |
A |
x,y,z |
1_555 |
23 |
6 |
19959 |
119.4 |
-0.1 |
0.270 |
1 |
0 |
0 |
0.010 |
15 |
|
[H4B]A:760 |
13 |
1 |
398 |
◊ |
B |
x,y,z |
1_555 |
21 |
6 |
20139 |
116.6 |
-0.2 |
0.254 |
1 |
0 |
0 |
0.010 |
Average: |
118.0 |
-0.1 |
0.262 |
1 |
0 |
0 |
0.010 |
11 |
16 |
|
[ACT]B:860 |
4 |
1 |
181 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
20139 |
113.1 |
-1.2 |
0.518 |
1 |
0 |
0 |
0.014 |
12 |
17 |
|
[ACT]A:860 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
19959 |
111.4 |
-1.3 |
0.483 |
1 |
0 |
0 |
0.015 |
13 |
18 |
|
[H4B]A:760 |
5 |
1 |
398 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
816 |
44.6 |
-1.2 |
0.427 |
1 |
0 |
0 |
0.030 |
19 |
|
[H4B]B:760 |
5 |
1 |
395 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
814 |
42.9 |
-1.0 |
0.456 |
2 |
0 |
0 |
0.030 |
Average: |
43.8 |
-1.1 |
0.442 |
2 |
0 |
0 |
0.030 |
14 |
20 |
|
[7F5]B:800 |
3 |
1 |
604 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
19959 |
43.3 |
0.9 |
0.475 |
0 |
0 |
0 |
0.000 |
21 |
|
[7F5]A:800 |
3 |
1 |
605 |
◊ |
B |
x,y,z |
1_555 |
6 |
1 |
20139 |
43.2 |
0.8 |
0.475 |
0 |
0 |
0 |
0.000 |
Average: |
43.3 |
0.9 |
0.475 |
0 |
0 |
0 |
0.000 |
15 |
22 |
|
[ACT]A:860 |
3 |
1 |
183 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
816 |
38.7 |
-1.2 |
0.753 |
0 |
0 |
0 |
0.010 |
16 |
23 |
|
[ZN]B:900 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20139 |
34.8 |
-20.0 |
0.000 |
0 |
0 |
0 |
0.255 |
24 |
|
[ZN]B:900 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
19959 |
34.8 |
-20.6 |
0.000 |
0 |
0 |
0 |
0.255 |
Average: |
34.8 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.255 |
17 |
25 |
|
[ACT]B:860 |
3 |
1 |
181 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
814 |
31.7 |
-0.7 |
0.814 |
0 |
0 |
0 |
0.006 |
18 |
26 |
|
B |
3 |
2 |
20139 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
5 |
3 |
20139 |
19.9 |
0.8 |
0.833 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
A |
4 |
3 |
19959 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
20139 |
18.9 |
-0.2 |
0.448 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[7F5]A:800 |
2 |
1 |
605 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
3 |
1 |
398 |
12.5 |
0.1 |
0.340 |
0 |
0 |
0 |
0.000 |
29 |
|
[7F5]B:800 |
2 |
1 |
604 |
f |
[H4B]B:760 |
x,y,z |
1_555 |
2 |
1 |
395 |
9.8 |
0.1 |
0.366 |
0 |
0 |
0 |
0.000 |
Average: |
11.2 |
0.1 |
0.353 |
0 |
0 |
0 |
0.000 |
|