| ## |
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 |
270 |
71 |
20195 |
◊ |
A |
x,y,z |
1_555 |
267 |
69 |
19996 |
2636.4 |
-37.8 |
0.008 |
40 |
9 |
0 |
0.461 |
| 2 |
2 |
|
A |
68 |
19 |
19996 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
68 |
18 |
20195 |
651.1 |
-1.1 |
0.703 |
17 |
0 |
0 |
0.000 |
| 3 |
3 |
|
[HEM]B:801 |
42 |
1 |
819 |
f |
B |
x,y,z |
1_555 |
79 |
24 |
20195 |
527.7 |
-18.5 |
0.293 |
1 |
0 |
0 |
0.306 |
4 |
|
[HEM]A:801 |
42 |
1 |
815 |
f |
A |
x,y,z |
1_555 |
78 |
23 |
19996 |
526.4 |
-18.3 |
0.302 |
1 |
0 |
0 |
0.306 |
| Average: |
527.0 |
-18.4 |
0.297 |
1 |
0 |
0 |
0.306 |
| 4 |
5 |
|
B |
49 |
15 |
20195 |
x |
B |
x-1,y,z |
1_455 |
50 |
15 |
20195 |
459.7 |
1.8 |
0.788 |
3 |
0 |
0 |
0.000 |
| 5 |
6 |
|
[W80]A:803 |
25 |
1 |
612 |
f |
A |
x,y,z |
1_555 |
49 |
24 |
19996 |
337.0 |
-3.3 |
0.772 |
3 |
0 |
0 |
0.037 |
| 6 |
7 |
|
[W80]B:803 |
25 |
1 |
599 |
f |
B |
x,y,z |
1_555 |
46 |
24 |
20195 |
327.8 |
-3.5 |
0.733 |
3 |
0 |
0 |
0.039 |
| 7 |
8 |
|
B |
42 |
12 |
20195 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
33 |
9 |
19996 |
322.6 |
-1.2 |
0.584 |
2 |
3 |
0 |
0.000 |
| 8 |
9 |
|
A |
27 |
13 |
19996 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
29 |
10 |
20195 |
202.2 |
1.4 |
0.813 |
1 |
2 |
0 |
0.000 |
| 9 |
10 |
|
[H4B]B:802 |
17 |
1 |
397 |
f |
B |
x,y,z |
1_555 |
28 |
9 |
20195 |
200.7 |
2.0 |
0.453 |
2 |
0 |
0 |
0.000 |
11 |
|
[H4B]A:802 |
17 |
1 |
397 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
19996 |
195.7 |
1.9 |
0.458 |
2 |
0 |
0 |
0.000 |
| Average: |
198.2 |
2.0 |
0.456 |
2 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[W80]B:803 |
18 |
1 |
599 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
33 |
1 |
819 |
155.6 |
-5.3 |
0.928 |
0 |
0 |
0 |
0.043 |
| 11 |
13 |
|
[W80]A:803 |
18 |
1 |
612 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
31 |
1 |
815 |
144.6 |
-5.2 |
0.933 |
0 |
0 |
0 |
0.042 |
| 12 |
14 |
|
[H4B]B:802 |
13 |
1 |
397 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
19996 |
120.7 |
-0.0 |
0.264 |
1 |
0 |
0 |
0.007 |
15 |
|
[H4B]A:802 |
13 |
1 |
397 |
◊ |
B |
x,y,z |
1_555 |
21 |
6 |
20195 |
118.5 |
-0.0 |
0.279 |
1 |
0 |
0 |
0.007 |
| Average: |
119.6 |
-0.0 |
0.272 |
1 |
0 |
0 |
0.007 |
| 13 |
16 |
|
[ACT]B:804 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
20195 |
114.8 |
-1.3 |
0.511 |
1 |
0 |
0 |
0.014 |
| 14 |
17 |
|
[ACT]A:804 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
19996 |
112.4 |
-1.3 |
0.499 |
1 |
0 |
0 |
0.014 |
| 15 |
18 |
|
[H4B]B:802 |
5 |
1 |
397 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
5 |
1 |
819 |
43.9 |
-1.1 |
0.443 |
2 |
0 |
0 |
0.031 |
19 |
|
[H4B]A:802 |
4 |
1 |
397 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
6 |
1 |
815 |
43.7 |
-0.9 |
0.531 |
2 |
0 |
0 |
0.031 |
| Average: |
43.8 |
-1.0 |
0.487 |
2 |
0 |
0 |
0.031 |
| 16 |
20 |
|
[ACT]A:804 |
3 |
1 |
183 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
5 |
1 |
815 |
36.1 |
-1.1 |
0.750 |
0 |
0 |
0 |
0.009 |
| 17 |
21 |
|
[ACT]B:804 |
3 |
1 |
184 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
5 |
1 |
819 |
34.6 |
-1.0 |
0.751 |
0 |
0 |
0 |
0.008 |
| 18 |
22 |
|
[ZN]A:805 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20195 |
34.1 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.247 |
23 |
|
[ZN]A:805 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
19996 |
33.9 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.247 |
| Average: |
34.0 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.247 |
| 19 |
24 |
|
[W80]A:803 |
2 |
1 |
612 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
20195 |
29.1 |
-0.4 |
0.589 |
0 |
0 |
0 |
0.003 |
| 20 |
25 |
|
A |
5 |
3 |
19996 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
20195 |
21.5 |
0.1 |
0.631 |
0 |
0 |
0 |
0.000 |
| 21 |
26 |
|
B |
1 |
1 |
20195 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
4 |
3 |
20195 |
20.4 |
1.0 |
0.870 |
0 |
0 |
0 |
0.000 |
| 22 |
27 |
|
[W80]B:803 |
1 |
1 |
599 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
19996 |
10.1 |
-0.2 |
0.558 |
0 |
0 |
0 |
0.002 |
| 23 |
28 |
|
[W80]A:803 |
2 |
1 |
612 |
f |
[H4B]A:802 |
x,y,z |
1_555 |
1 |
1 |
397 |
9.5 |
-0.1 |
0.308 |
0 |
0 |
0 |
0.000 |
| 24 |
29 |
|
A |
2 |
1 |
19996 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
19996 |
4.4 |
-0.5 |
0.157 |
0 |
0 |
0 |
0.000 |
| 25 |
30 |
|
A |
1 |
1 |
19996 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
19996 |
3.4 |
-0.1 |
0.385 |
0 |
0 |
0 |
0.000 |
| 26 |
31 |
|
[W80]B:803 |
1 |
1 |
599 |
f |
[H4B]B:802 |
x,y,z |
1_555 |
1 |
1 |
397 |
0.5 |
-0.0 |
0.423 |
0 |
0 |
0 |
0.000 |
|