## |
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 |
289 |
74 |
20060 |
◊ |
A |
x,y,z |
1_555 |
282 |
73 |
19923 |
2718.8 |
-37.0 |
0.016 |
29 |
10 |
0 |
0.446 |
2 |
2 |
|
A |
87 |
26 |
19923 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
87 |
27 |
20060 |
709.2 |
-2.1 |
0.681 |
6 |
4 |
0 |
0.000 |
3 |
3 |
|
[HEM]A:501 |
42 |
1 |
821 |
f |
A |
x,y,z |
1_555 |
78 |
24 |
19923 |
525.0 |
-18.2 |
0.329 |
1 |
0 |
0 |
0.324 |
4 |
|
[HEM]B:501 |
41 |
1 |
821 |
f |
B |
x,y,z |
1_555 |
79 |
24 |
20060 |
523.2 |
-18.2 |
0.347 |
1 |
0 |
0 |
0.324 |
Average: |
524.1 |
-18.2 |
0.338 |
1 |
0 |
0 |
0.324 |
4 |
5 |
|
A |
57 |
17 |
19923 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
47 |
14 |
19923 |
455.8 |
-4.5 |
0.354 |
2 |
2 |
0 |
0.000 |
5 |
6 |
|
B |
48 |
14 |
20060 |
x |
B |
x-1,y,z |
1_455 |
43 |
10 |
20060 |
417.4 |
-3.5 |
0.430 |
3 |
0 |
0 |
0.000 |
6 |
7 |
|
[9OJ]A:503 |
23 |
1 |
590 |
f |
A |
x,y,z |
1_555 |
36 |
17 |
19923 |
276.5 |
-2.0 |
0.382 |
3 |
0 |
0 |
0.057 |
8 |
|
[9OJ]B:503 |
25 |
1 |
592 |
f |
B |
x,y,z |
1_555 |
34 |
16 |
20060 |
273.6 |
-1.9 |
0.391 |
3 |
0 |
0 |
0.057 |
Average: |
275.0 |
-1.9 |
0.387 |
3 |
0 |
0 |
0.057 |
7 |
9 |
|
[H4B]A:502 |
17 |
1 |
395 |
f |
A |
x,y,z |
1_555 |
26 |
8 |
19923 |
170.9 |
2.5 |
0.529 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]B:502 |
17 |
1 |
394 |
f |
B |
x,y,z |
1_555 |
26 |
10 |
20060 |
170.2 |
2.3 |
0.516 |
2 |
0 |
0 |
0.000 |
Average: |
170.6 |
2.4 |
0.522 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
[9OJ]A:503 |
18 |
1 |
590 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
35 |
1 |
821 |
164.1 |
-5.1 |
0.731 |
0 |
0 |
0 |
0.088 |
12 |
|
[9OJ]B:503 |
17 |
1 |
592 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
35 |
1 |
821 |
162.1 |
-5.0 |
0.747 |
0 |
0 |
0 |
0.088 |
Average: |
163.1 |
-5.1 |
0.739 |
0 |
0 |
0 |
0.088 |
9 |
13 |
|
[H4B]B:502 |
13 |
1 |
394 |
◊ |
A |
x,y,z |
1_555 |
24 |
6 |
19923 |
109.4 |
-0.2 |
0.272 |
1 |
0 |
0 |
0.006 |
14 |
|
[H4B]A:502 |
13 |
1 |
395 |
◊ |
B |
x,y,z |
1_555 |
21 |
6 |
20060 |
107.8 |
0.4 |
0.341 |
1 |
0 |
0 |
0.006 |
Average: |
108.6 |
0.1 |
0.307 |
1 |
0 |
0 |
0.006 |
10 |
15 |
|
B |
13 |
5 |
20060 |
◊ |
A |
x-1,y,z |
1_455 |
9 |
2 |
19923 |
98.3 |
2.4 |
0.898 |
1 |
2 |
0 |
0.000 |
11 |
16 |
|
[GOL]B:504 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
20060 |
81.7 |
0.2 |
0.644 |
3 |
0 |
0 |
0.010 |
12 |
17 |
|
[GOL]A:504 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
19923 |
76.4 |
-0.5 |
0.508 |
1 |
0 |
0 |
0.008 |
13 |
18 |
|
B |
13 |
4 |
20060 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
11 |
5 |
19923 |
75.4 |
-0.5 |
0.481 |
0 |
0 |
0 |
0.000 |
14 |
19 |
|
[GOL]A:504 |
5 |
1 |
217 |
◊ |
B |
x,y,z |
1_555 |
15 |
3 |
20060 |
64.0 |
-0.2 |
0.584 |
1 |
0 |
0 |
0.006 |
15 |
20 |
|
[GOL]B:504 |
6 |
1 |
218 |
◊ |
A |
x,y,z |
1_555 |
16 |
3 |
19923 |
51.7 |
0.2 |
0.647 |
0 |
0 |
0 |
0.000 |
16 |
21 |
|
A |
8 |
4 |
19923 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
2 |
20060 |
46.5 |
-0.4 |
0.451 |
0 |
0 |
0 |
0.000 |
17 |
22 |
|
[H4B]A:502 |
5 |
1 |
395 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
5 |
1 |
821 |
42.7 |
-1.1 |
0.457 |
2 |
0 |
0 |
0.036 |
23 |
|
[H4B]B:502 |
5 |
1 |
394 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
5 |
1 |
821 |
41.6 |
-1.3 |
0.429 |
2 |
0 |
0 |
0.036 |
Average: |
42.2 |
-1.2 |
0.443 |
2 |
0 |
0 |
0.036 |
18 |
24 |
|
[GOL]B:504 |
5 |
1 |
218 |
f |
[H4B]B:502 |
x,y,z |
1_555 |
7 |
1 |
394 |
41.1 |
0.1 |
0.300 |
4 |
0 |
0 |
0.014 |
19 |
25 |
|
[9OJ]B:503 |
4 |
1 |
592 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
19923 |
40.4 |
-0.5 |
0.269 |
0 |
0 |
0 |
0.006 |
26 |
|
[9OJ]A:503 |
4 |
1 |
590 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
20060 |
35.1 |
-0.2 |
0.373 |
0 |
0 |
0 |
0.006 |
Average: |
37.7 |
-0.4 |
0.321 |
0 |
0 |
0 |
0.006 |
20 |
27 |
|
[GOL]A:504 |
5 |
1 |
217 |
f |
[H4B]A:502 |
x,y,z |
1_555 |
6 |
1 |
395 |
40.3 |
0.2 |
0.328 |
3 |
0 |
0 |
0.009 |
21 |
28 |
|
[GOL]B:504 |
4 |
1 |
218 |
f |
[9OJ]B:503 |
x,y,z |
1_555 |
8 |
1 |
592 |
37.5 |
-1.0 |
0.352 |
0 |
0 |
0 |
0.009 |
22 |
29 |
|
[ZN]A:505 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20060 |
35.2 |
-20.7 |
0.000 |
0 |
0 |
0 |
0.261 |
30 |
|
[ZN]A:505 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
19923 |
35.0 |
-20.0 |
0.000 |
0 |
0 |
0 |
0.261 |
Average: |
35.1 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.261 |
23 |
31 |
|
[GOL]A:504 |
3 |
1 |
217 |
f |
[9OJ]A:503 |
x,y,z |
1_555 |
9 |
1 |
590 |
29.7 |
-0.3 |
0.520 |
0 |
0 |
0 |
0.002 |
24 |
32 |
|
[9OJ]A:503 |
5 |
1 |
590 |
f |
[H4B]A:502 |
x,y,z |
1_555 |
3 |
1 |
395 |
17.0 |
-0.4 |
0.308 |
0 |
0 |
0 |
0.007 |
33 |
|
[9OJ]B:503 |
4 |
1 |
592 |
f |
[H4B]B:502 |
x,y,z |
1_555 |
3 |
1 |
394 |
14.6 |
-0.5 |
0.301 |
0 |
0 |
0 |
0.007 |
Average: |
15.8 |
-0.4 |
0.305 |
0 |
0 |
0 |
0.007 |
25 |
34 |
|
A |
1 |
1 |
19923 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
3 |
2 |
19923 |
12.7 |
0.1 |
0.695 |
0 |
0 |
0 |
0.000 |
|