## |
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 |
271 |
68 |
20095 |
◊ |
A |
x,y,z |
1_555 |
262 |
68 |
19904 |
2636.1 |
-39.4 |
0.007 |
36 |
10 |
0 |
0.456 |
2 |
2 |
|
A |
66 |
19 |
19904 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
68 |
18 |
20095 |
645.3 |
-1.0 |
0.725 |
14 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]A:750 |
43 |
1 |
816 |
f |
A |
x,y,z |
1_555 |
76 |
23 |
19904 |
509.4 |
-16.9 |
0.312 |
0 |
0 |
0 |
0.269 |
4 |
|
[HEM]B:750 |
43 |
1 |
810 |
f |
B |
x,y,z |
1_555 |
76 |
23 |
20095 |
501.5 |
-16.7 |
0.308 |
0 |
0 |
0 |
0.269 |
Average: |
505.4 |
-16.8 |
0.310 |
0 |
0 |
0 |
0.269 |
4 |
5 |
|
B |
49 |
15 |
20095 |
x |
B |
x-1,y,z |
1_455 |
52 |
15 |
20095 |
460.6 |
1.4 |
0.729 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
[71S]A:800 |
26 |
1 |
665 |
f |
A |
x,y,z |
1_555 |
56 |
23 |
19904 |
369.6 |
-2.2 |
0.602 |
3 |
0 |
0 |
0.056 |
7 |
|
[71S]B:800 |
27 |
1 |
662 |
f |
B |
x,y,z |
1_555 |
56 |
24 |
20095 |
365.5 |
-2.1 |
0.591 |
3 |
0 |
0 |
0.056 |
Average: |
367.6 |
-2.1 |
0.596 |
3 |
0 |
0 |
0.056 |
6 |
8 |
|
B |
30 |
12 |
20095 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
4_645 |
34 |
9 |
19904 |
267.5 |
-2.9 |
0.394 |
2 |
1 |
0 |
0.000 |
7 |
9 |
|
[H4B]B:760 |
17 |
1 |
401 |
f |
B |
x,y,z |
1_555 |
26 |
8 |
20095 |
194.8 |
1.7 |
0.427 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]A:760 |
17 |
1 |
400 |
f |
A |
x,y,z |
1_555 |
26 |
8 |
19904 |
191.3 |
1.8 |
0.437 |
2 |
0 |
0 |
0.000 |
Average: |
193.0 |
1.8 |
0.432 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
23 |
10 |
19904 |
◊ |
B |
-x,y-1/2,-z+1/2 |
4_545 |
24 |
9 |
20095 |
180.2 |
0.8 |
0.766 |
0 |
3 |
0 |
0.000 |
9 |
12 |
|
[71S]B:800 |
21 |
1 |
662 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
32 |
1 |
810 |
175.7 |
-6.5 |
0.792 |
3 |
0 |
0 |
0.126 |
13 |
|
[71S]A:800 |
19 |
1 |
665 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
31 |
1 |
816 |
173.0 |
-6.5 |
0.788 |
3 |
0 |
0 |
0.126 |
Average: |
174.3 |
-6.5 |
0.790 |
3 |
0 |
0 |
0.126 |
10 |
14 |
|
[H4B]B:760 |
13 |
1 |
401 |
◊ |
A |
x,y,z |
1_555 |
21 |
6 |
19904 |
117.5 |
-0.1 |
0.271 |
1 |
0 |
0 |
0.009 |
15 |
|
[H4B]A:760 |
13 |
1 |
400 |
◊ |
B |
x,y,z |
1_555 |
23 |
6 |
20095 |
115.8 |
-0.1 |
0.274 |
1 |
0 |
0 |
0.009 |
Average: |
116.7 |
-0.1 |
0.273 |
1 |
0 |
0 |
0.009 |
11 |
16 |
|
[ACT]B:860 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
20095 |
113.8 |
-1.3 |
0.483 |
1 |
0 |
0 |
0.014 |
12 |
17 |
|
[ACT]A:860 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
19904 |
110.8 |
-1.4 |
0.498 |
1 |
0 |
0 |
0.014 |
13 |
18 |
|
[H4B]A:760 |
4 |
1 |
400 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
816 |
40.1 |
-1.2 |
0.445 |
1 |
0 |
0 |
0.027 |
19 |
|
[H4B]B:760 |
3 |
1 |
401 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
810 |
40.0 |
-1.3 |
0.435 |
1 |
0 |
0 |
0.027 |
Average: |
40.0 |
-1.2 |
0.440 |
1 |
0 |
0 |
0.027 |
14 |
20 |
|
[ACT]A:860 |
3 |
1 |
182 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
816 |
36.6 |
-1.1 |
0.751 |
0 |
0 |
0 |
0.009 |
15 |
21 |
|
[ZN]A:721 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
19904 |
34.1 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.245 |
22 |
|
[ZN]A:721 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20095 |
34.0 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.245 |
Average: |
34.0 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.245 |
16 |
23 |
|
[ACT]B:860 |
3 |
1 |
182 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
810 |
33.6 |
-1.0 |
0.654 |
0 |
0 |
0 |
0.008 |
17 |
24 |
|
[71S]A:800 |
1 |
1 |
665 |
◊ |
B |
x,y,z |
1_555 |
6 |
1 |
20095 |
32.9 |
-1.1 |
0.156 |
0 |
0 |
0 |
0.017 |
25 |
|
[71S]B:800 |
1 |
1 |
662 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
19904 |
31.5 |
-1.0 |
0.158 |
0 |
0 |
0 |
0.017 |
Average: |
32.2 |
-1.0 |
0.157 |
0 |
0 |
0 |
0.017 |
18 |
26 |
|
[71S]A:800 |
2 |
1 |
665 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
3 |
1 |
400 |
29.3 |
-0.1 |
0.317 |
1 |
0 |
0 |
0.009 |
27 |
|
[71S]B:800 |
2 |
1 |
662 |
f |
[H4B]B:760 |
x,y,z |
1_555 |
3 |
1 |
401 |
28.9 |
-0.1 |
0.353 |
1 |
0 |
0 |
0.009 |
Average: |
29.1 |
-0.1 |
0.335 |
1 |
0 |
0 |
0.009 |
19 |
28 |
|
A |
2 |
1 |
19904 |
x |
A |
x-1/2,-y+1/2,-z |
3_455 |
1 |
1 |
19904 |
15.8 |
-0.5 |
0.199 |
0 |
0 |
0 |
0.000 |
20 |
29 |
|
A |
3 |
2 |
19904 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
20095 |
9.0 |
0.1 |
0.649 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
A |
1 |
1 |
19904 |
x |
A |
-x,y-1/2,-z+1/2 |
4_545 |
1 |
1 |
19904 |
0.8 |
0.1 |
0.736 |
0 |
0 |
0 |
0.000 |
22 |
31 |
|
B |
1 |
1 |
20095 |
x |
B |
x-1/2,-y+1/2,-z+1 |
3_456 |
1 |
1 |
20095 |
0.2 |
0.0 |
0.669 |
0 |
0 |
0 |
0.000 |
|