## |
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 |
263 |
69 |
20168 |
◊ |
A |
x,y,z |
1_555 |
263 |
69 |
20016 |
2601.1 |
-38.3 |
0.008 |
37 |
10 |
0 |
0.456 |
2 |
2 |
|
A |
67 |
20 |
20016 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
67 |
18 |
20168 |
657.1 |
-0.5 |
0.744 |
14 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]B:801 |
43 |
1 |
815 |
f |
B |
x,y,z |
1_555 |
73 |
23 |
20168 |
514.9 |
-17.2 |
0.283 |
0 |
0 |
0 |
0.277 |
4 |
|
[HEM]A:801 |
43 |
1 |
818 |
f |
A |
x,y,z |
1_555 |
75 |
22 |
20016 |
514.2 |
-17.0 |
0.309 |
0 |
0 |
0 |
0.277 |
Average: |
514.5 |
-17.1 |
0.296 |
0 |
0 |
0 |
0.277 |
4 |
5 |
|
B |
49 |
15 |
20168 |
x |
B |
x-1,y,z |
1_455 |
49 |
15 |
20168 |
432.9 |
-0.5 |
0.645 |
2 |
0 |
0 |
0.000 |
5 |
6 |
|
[Q13]A:803 |
23 |
1 |
634 |
f |
A |
x,y,z |
1_555 |
48 |
20 |
20016 |
350.2 |
-2.3 |
0.531 |
3 |
0 |
0 |
0.061 |
7 |
|
[Q13]B:803 |
23 |
1 |
629 |
f |
B |
x,y,z |
1_555 |
48 |
19 |
20168 |
344.5 |
-2.6 |
0.467 |
3 |
0 |
0 |
0.061 |
Average: |
347.4 |
-2.4 |
0.499 |
3 |
0 |
0 |
0.061 |
6 |
8 |
|
B |
39 |
12 |
20168 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
33 |
9 |
20016 |
301.9 |
-2.7 |
0.442 |
3 |
1 |
0 |
0.000 |
7 |
9 |
|
[H4B]B:802 |
17 |
1 |
400 |
f |
B |
x,y,z |
1_555 |
29 |
8 |
20168 |
200.0 |
2.2 |
0.479 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]A:802 |
17 |
1 |
401 |
f |
A |
x,y,z |
1_555 |
30 |
9 |
20016 |
196.1 |
1.9 |
0.445 |
2 |
0 |
0 |
0.000 |
Average: |
198.0 |
2.0 |
0.462 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
26 |
12 |
20016 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
22 |
10 |
20168 |
186.0 |
0.6 |
0.752 |
1 |
2 |
0 |
0.000 |
9 |
12 |
|
[Q13]B:803 |
17 |
1 |
629 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
31 |
1 |
815 |
171.8 |
-5.6 |
0.806 |
4 |
0 |
0 |
0.120 |
13 |
|
[Q13]A:803 |
17 |
1 |
634 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
31 |
1 |
818 |
170.7 |
-5.7 |
0.800 |
4 |
0 |
0 |
0.120 |
Average: |
171.3 |
-5.6 |
0.803 |
4 |
0 |
0 |
0.120 |
10 |
14 |
|
[H4B]B:802 |
13 |
1 |
400 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
20016 |
120.8 |
-0.1 |
0.266 |
1 |
0 |
0 |
0.008 |
15 |
|
[H4B]A:802 |
13 |
1 |
401 |
◊ |
B |
x,y,z |
1_555 |
21 |
6 |
20168 |
120.4 |
-0.1 |
0.272 |
1 |
0 |
0 |
0.008 |
Average: |
120.6 |
-0.1 |
0.269 |
1 |
0 |
0 |
0.008 |
11 |
16 |
|
[ACT]B:804 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
20168 |
114.6 |
-1.3 |
0.478 |
1 |
0 |
0 |
0.014 |
12 |
17 |
|
[ACT]A:804 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
20016 |
109.8 |
-1.3 |
0.496 |
1 |
0 |
0 |
0.014 |
13 |
18 |
|
[H4B]B:802 |
5 |
1 |
400 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
5 |
1 |
815 |
41.3 |
-1.2 |
0.428 |
2 |
0 |
0 |
0.030 |
19 |
|
[H4B]A:802 |
4 |
1 |
401 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
5 |
1 |
818 |
41.2 |
-1.2 |
0.449 |
1 |
0 |
0 |
0.030 |
Average: |
41.2 |
-1.2 |
0.438 |
2 |
0 |
0 |
0.030 |
14 |
20 |
|
[ACT]A:804 |
3 |
1 |
183 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
5 |
1 |
818 |
37.3 |
-1.2 |
0.751 |
0 |
0 |
0 |
0.009 |
15 |
21 |
|
[ZN]A:805 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20016 |
34.4 |
-20.5 |
0.000 |
0 |
0 |
0 |
0.247 |
22 |
|
[ZN]A:805 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20168 |
34.2 |
-20.0 |
0.000 |
0 |
0 |
0 |
0.247 |
Average: |
34.3 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.247 |
16 |
23 |
|
[ACT]B:804 |
3 |
1 |
182 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
5 |
1 |
815 |
32.4 |
-0.9 |
0.752 |
0 |
0 |
0 |
0.007 |
17 |
24 |
|
[Q13]A:803 |
2 |
1 |
634 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
20168 |
30.1 |
-1.0 |
0.276 |
0 |
0 |
0 |
0.016 |
25 |
|
[Q13]B:803 |
1 |
1 |
629 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
20016 |
29.9 |
-1.0 |
0.179 |
0 |
0 |
0 |
0.016 |
Average: |
30.0 |
-1.0 |
0.228 |
0 |
0 |
0 |
0.016 |
18 |
26 |
|
B |
1 |
1 |
20168 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
2 |
20168 |
15.4 |
0.8 |
0.909 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
A |
2 |
1 |
20016 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
20016 |
9.0 |
-0.3 |
0.310 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[Q13]A:803 |
2 |
1 |
634 |
f |
[H4B]A:802 |
x,y,z |
1_555 |
1 |
1 |
401 |
8.9 |
-0.3 |
0.257 |
0 |
0 |
0 |
0.005 |
29 |
|
[Q13]B:803 |
2 |
1 |
629 |
f |
[H4B]B:802 |
x,y,z |
1_555 |
1 |
1 |
400 |
8.3 |
-0.3 |
0.253 |
0 |
0 |
0 |
0.005 |
Average: |
8.6 |
-0.3 |
0.255 |
0 |
0 |
0 |
0.005 |
21 |
30 |
|
A |
1 |
1 |
20016 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
20168 |
3.6 |
-0.0 |
0.526 |
0 |
0 |
0 |
0.000 |
|