## |
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 |
265 |
68 |
20062 |
◊ |
A |
x,y,z |
1_555 |
263 |
68 |
19969 |
2565.8 |
-39.4 |
0.005 |
44 |
9 |
0 |
0.458 |
2 |
2 |
|
A |
70 |
19 |
19969 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
70 |
19 |
20062 |
665.8 |
-0.1 |
0.759 |
17 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]A:801 |
42 |
1 |
820 |
f |
A |
x,y,z |
1_555 |
76 |
24 |
19969 |
515.6 |
-18.1 |
0.281 |
2 |
0 |
0 |
0.287 |
4 |
|
[HEM]B:801 |
43 |
1 |
817 |
f |
B |
x,y,z |
1_555 |
78 |
24 |
20062 |
514.3 |
-18.0 |
0.332 |
2 |
0 |
0 |
0.287 |
Average: |
515.0 |
-18.0 |
0.307 |
2 |
0 |
0 |
0.287 |
4 |
5 |
|
B |
51 |
15 |
20062 |
x |
B |
x-1,y,z |
1_455 |
52 |
15 |
20062 |
477.5 |
0.1 |
0.707 |
6 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
40 |
11 |
20062 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
35 |
10 |
19969 |
319.9 |
-1.1 |
0.585 |
2 |
2 |
0 |
0.000 |
6 |
7 |
|
[P64]A:803 |
24 |
1 |
582 |
f |
A |
x,y,z |
1_555 |
35 |
17 |
19969 |
274.9 |
-3.5 |
0.271 |
3 |
0 |
0 |
0.073 |
8 |
|
[P64]B:803 |
24 |
1 |
587 |
f |
B |
x,y,z |
1_555 |
32 |
16 |
20062 |
256.9 |
-3.5 |
0.306 |
3 |
0 |
0 |
0.073 |
Average: |
265.9 |
-3.5 |
0.289 |
3 |
0 |
0 |
0.073 |
7 |
9 |
|
[H4B]A:802 |
17 |
1 |
400 |
f |
A |
x,y,z |
1_555 |
25 |
8 |
19969 |
192.0 |
1.8 |
0.431 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]B:802 |
17 |
1 |
397 |
f |
B |
x,y,z |
1_555 |
26 |
9 |
20062 |
188.9 |
1.8 |
0.434 |
2 |
0 |
0 |
0.000 |
Average: |
190.5 |
1.8 |
0.433 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
25 |
11 |
19969 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
20 |
7 |
20062 |
170.4 |
1.2 |
0.792 |
1 |
2 |
0 |
0.000 |
9 |
12 |
|
[P64]B:803 |
17 |
1 |
587 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
31 |
1 |
817 |
156.0 |
-5.7 |
0.665 |
2 |
0 |
0 |
0.096 |
13 |
|
[P64]A:803 |
18 |
1 |
582 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
32 |
1 |
820 |
152.4 |
-5.6 |
0.678 |
1 |
0 |
0 |
0.096 |
Average: |
154.2 |
-5.6 |
0.672 |
2 |
0 |
0 |
0.096 |
10 |
14 |
|
[H4B]B:802 |
13 |
1 |
397 |
◊ |
A |
x,y,z |
1_555 |
21 |
6 |
19969 |
115.2 |
-0.2 |
0.258 |
1 |
0 |
0 |
0.009 |
15 |
|
[H4B]A:802 |
13 |
1 |
400 |
◊ |
B |
x,y,z |
1_555 |
23 |
6 |
20062 |
114.9 |
-0.1 |
0.275 |
1 |
0 |
0 |
0.009 |
Average: |
115.0 |
-0.2 |
0.267 |
1 |
0 |
0 |
0.009 |
11 |
16 |
|
[ACT]B:804 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
20062 |
112.8 |
-1.3 |
0.500 |
1 |
0 |
0 |
0.013 |
12 |
17 |
|
[ACT]A:804 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
19969 |
110.3 |
-1.3 |
0.495 |
1 |
0 |
0 |
0.013 |
13 |
18 |
|
[P64]A:803 |
4 |
1 |
582 |
◊ |
B |
x,y,z |
1_555 |
8 |
1 |
20062 |
45.3 |
-0.2 |
0.484 |
0 |
0 |
0 |
0.005 |
19 |
|
[P64]B:803 |
4 |
1 |
587 |
◊ |
A |
x,y,z |
1_555 |
7 |
1 |
19969 |
43.8 |
-0.5 |
0.462 |
0 |
0 |
0 |
0.005 |
Average: |
44.6 |
-0.3 |
0.473 |
0 |
0 |
0 |
0.005 |
14 |
20 |
|
[H4B]A:802 |
5 |
1 |
400 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
5 |
1 |
820 |
41.5 |
-1.1 |
0.431 |
2 |
0 |
0 |
0.031 |
21 |
|
[H4B]B:802 |
4 |
1 |
397 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
5 |
1 |
817 |
41.2 |
-1.2 |
0.462 |
2 |
0 |
0 |
0.031 |
Average: |
41.3 |
-1.1 |
0.446 |
2 |
0 |
0 |
0.031 |
15 |
22 |
|
[ACT]A:804 |
3 |
1 |
182 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
5 |
1 |
820 |
38.0 |
-1.2 |
0.745 |
0 |
0 |
0 |
0.009 |
16 |
23 |
|
[ACT]B:804 |
3 |
1 |
182 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
5 |
1 |
817 |
35.3 |
-1.1 |
0.753 |
0 |
0 |
0 |
0.008 |
17 |
24 |
|
[ZN]A:805 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20062 |
34.4 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.236 |
25 |
|
[ZN]A:805 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
19969 |
34.3 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.236 |
Average: |
34.4 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.236 |
18 |
26 |
|
[P64]B:803 |
3 |
1 |
587 |
f |
[H4B]B:802 |
x,y,z |
1_555 |
3 |
1 |
397 |
23.2 |
-0.7 |
0.264 |
0 |
0 |
0 |
0.011 |
27 |
|
[P64]A:803 |
3 |
1 |
582 |
f |
[H4B]A:802 |
x,y,z |
1_555 |
3 |
1 |
400 |
23.1 |
-0.7 |
0.243 |
0 |
0 |
0 |
0.011 |
Average: |
23.2 |
-0.7 |
0.254 |
0 |
0 |
0 |
0.011 |
19 |
28 |
|
B |
2 |
1 |
20062 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
4 |
3 |
20062 |
22.4 |
1.0 |
0.880 |
1 |
0 |
0 |
0.000 |
20 |
29 |
|
A |
4 |
2 |
19969 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
2 |
20062 |
17.3 |
0.0 |
0.622 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
A |
1 |
1 |
19969 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
19969 |
2.2 |
0.2 |
0.808 |
0 |
0 |
0 |
0.000 |
22 |
31 |
|
A |
1 |
1 |
19969 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
19969 |
2.1 |
-0.1 |
0.444 |
0 |
0 |
0 |
0.000 |
|