## |
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 |
296 |
75 |
20435 |
◊ |
A |
x,y,z |
1_555 |
288 |
76 |
20182 |
2819.9 |
-37.3 |
0.016 |
31 |
9 |
0 |
0.471 |
2 |
2 |
|
A |
88 |
28 |
20182 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
92 |
29 |
20435 |
740.1 |
-2.6 |
0.652 |
7 |
8 |
0 |
0.000 |
3 |
3 |
|
[HEM]B:501 |
43 |
1 |
820 |
f |
B |
x,y,z |
1_555 |
96 |
25 |
20435 |
609.7 |
-21.3 |
0.385 |
1 |
0 |
0 |
0.388 |
4 |
|
[HEM]A:501 |
43 |
1 |
812 |
f |
A |
x,y,z |
1_555 |
94 |
25 |
20182 |
604.1 |
-21.0 |
0.355 |
1 |
0 |
0 |
0.388 |
Average: |
606.9 |
-21.2 |
0.370 |
1 |
0 |
0 |
0.388 |
4 |
5 |
|
A |
55 |
16 |
20182 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
52 |
14 |
20182 |
437.9 |
-4.1 |
0.390 |
2 |
1 |
0 |
0.000 |
5 |
6 |
|
B |
29 |
9 |
20435 |
x |
B |
x-1,y,z |
1_455 |
25 |
6 |
20435 |
275.0 |
-3.0 |
0.312 |
1 |
0 |
0 |
0.000 |
6 |
7 |
|
[H4B]B:502 |
17 |
1 |
393 |
f |
B |
x,y,z |
1_555 |
26 |
9 |
20435 |
182.4 |
2.4 |
0.528 |
2 |
0 |
0 |
0.000 |
8 |
|
[H4B]A:502 |
17 |
1 |
397 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
20182 |
178.2 |
2.4 |
0.512 |
2 |
0 |
0 |
0.000 |
Average: |
180.3 |
2.4 |
0.520 |
2 |
0 |
0 |
0.000 |
7 |
9 |
|
[H4B]A:502 |
13 |
1 |
397 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
20435 |
113.9 |
-0.2 |
0.269 |
1 |
0 |
0 |
0.011 |
10 |
|
[H4B]B:502 |
13 |
1 |
393 |
◊ |
A |
x,y,z |
1_555 |
24 |
6 |
20182 |
111.4 |
-0.1 |
0.281 |
1 |
0 |
0 |
0.011 |
Average: |
112.6 |
-0.2 |
0.275 |
1 |
0 |
0 |
0.011 |
8 |
11 |
|
[ACT]A:504 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
20182 |
113.1 |
-1.4 |
0.462 |
2 |
0 |
0 |
0.020 |
9 |
12 |
|
[ACT]B:504 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
20435 |
111.4 |
-1.4 |
0.489 |
2 |
0 |
0 |
0.020 |
10 |
13 |
|
[GOL]B:506 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
20435 |
94.8 |
0.4 |
0.659 |
2 |
0 |
0 |
0.005 |
11 |
14 |
|
[ACT]B:505 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
20435 |
94.1 |
1.4 |
0.861 |
4 |
0 |
0 |
0.003 |
12 |
15 |
|
[GOL]A:506 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
20182 |
92.2 |
-0.1 |
0.571 |
3 |
0 |
0 |
0.013 |
13 |
16 |
|
[ACT]A:505 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
20182 |
91.0 |
1.3 |
0.862 |
3 |
0 |
0 |
0.000 |
14 |
17 |
|
[GOL]B:506 |
6 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
15 |
3 |
20182 |
61.7 |
0.3 |
0.662 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
[GOL]A:506 |
6 |
1 |
218 |
◊ |
B |
x,y,z |
1_555 |
15 |
3 |
20435 |
61.4 |
-0.3 |
0.566 |
0 |
0 |
0 |
0.002 |
16 |
19 |
|
B |
8 |
3 |
20435 |
◊ |
A |
x-1,y,z |
1_455 |
7 |
2 |
20182 |
60.8 |
0.2 |
0.461 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
A |
7 |
4 |
20182 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
2 |
20435 |
53.0 |
-0.6 |
0.433 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
B |
9 |
4 |
20435 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
2 |
20182 |
52.8 |
-0.6 |
0.428 |
0 |
0 |
0 |
0.000 |
19 |
22 |
|
[GOL]A:506 |
4 |
1 |
218 |
f |
[H4B]A:502 |
x,y,z |
1_555 |
7 |
1 |
397 |
45.6 |
-0.4 |
0.251 |
1 |
0 |
0 |
0.008 |
20 |
23 |
|
[H4B]B:502 |
3 |
1 |
393 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
5 |
1 |
820 |
43.0 |
-1.4 |
0.456 |
1 |
0 |
0 |
0.038 |
24 |
|
[H4B]A:502 |
5 |
1 |
397 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
5 |
1 |
812 |
42.9 |
-1.5 |
0.424 |
2 |
0 |
0 |
0.038 |
Average: |
43.0 |
-1.4 |
0.440 |
2 |
0 |
0 |
0.038 |
21 |
25 |
|
[GOL]B:506 |
4 |
1 |
219 |
f |
[H4B]B:502 |
x,y,z |
1_555 |
7 |
1 |
393 |
42.2 |
0.2 |
0.301 |
3 |
0 |
0 |
0.010 |
22 |
26 |
|
[ACT]B:504 |
3 |
1 |
183 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
5 |
1 |
820 |
38.0 |
-1.2 |
0.753 |
0 |
0 |
0 |
0.010 |
23 |
27 |
|
[ACT]A:504 |
3 |
1 |
183 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
5 |
1 |
812 |
36.6 |
-1.1 |
0.658 |
0 |
0 |
0 |
0.010 |
24 |
28 |
|
[ZN]A:507 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20435 |
34.8 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.267 |
29 |
|
[ZN]A:507 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20182 |
34.5 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.267 |
Average: |
34.7 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.267 |
25 |
30 |
|
A |
3 |
1 |
20182 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
2 |
20182 |
20.3 |
0.4 |
0.753 |
0 |
0 |
0 |
0.000 |
26 |
31 |
|
[ACT]B:505 |
1 |
1 |
182 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
1 |
1 |
820 |
16.9 |
-1.2 |
0.305 |
0 |
0 |
0 |
0.011 |
27 |
32 |
|
[ACT]A:505 |
1 |
1 |
185 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
2 |
1 |
812 |
14.9 |
-1.0 |
0.479 |
0 |
0 |
0 |
0.009 |
28 |
33 |
|
[GOL]B:506 |
1 |
1 |
219 |
f |
[ACT]B:505 |
x,y,z |
1_555 |
1 |
1 |
182 |
2.6 |
-0.1 |
0.500 |
0 |
0 |
0 |
0.000 |
|