## |
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 |
288 |
71 |
19835 |
◊ |
A |
x,y,z |
1_555 |
280 |
71 |
19814 |
2656.3 |
-39.1 |
0.011 |
34 |
9 |
0 |
0.430 |
2 |
2 |
|
A |
96 |
28 |
19814 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
88 |
28 |
19835 |
730.7 |
-3.6 |
0.630 |
7 |
7 |
0 |
0.000 |
3 |
3 |
|
[HEM]A:501 |
43 |
1 |
826 |
f |
A |
x,y,z |
1_555 |
80 |
25 |
19814 |
508.0 |
-17.5 |
0.362 |
3 |
0 |
0 |
0.280 |
4 |
|
[HEM]B:501 |
43 |
1 |
817 |
f |
B |
x,y,z |
1_555 |
81 |
24 |
19835 |
498.0 |
-17.0 |
0.353 |
1 |
0 |
0 |
0.280 |
Average: |
503.0 |
-17.2 |
0.357 |
2 |
0 |
0 |
0.280 |
4 |
5 |
|
A |
57 |
19 |
19814 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
54 |
14 |
19814 |
451.4 |
-4.3 |
0.430 |
1 |
1 |
0 |
0.000 |
5 |
6 |
|
B |
35 |
12 |
19835 |
x |
B |
x-1,y,z |
1_455 |
26 |
8 |
19835 |
295.1 |
-3.1 |
0.353 |
1 |
1 |
0 |
0.000 |
6 |
7 |
|
[Q14]B:503 |
24 |
1 |
618 |
f |
B |
x,y,z |
1_555 |
40 |
17 |
19835 |
292.3 |
-2.8 |
0.337 |
3 |
0 |
0 |
0.067 |
8 |
|
[Q14]A:503 |
22 |
1 |
620 |
f |
A |
x,y,z |
1_555 |
37 |
18 |
19814 |
288.7 |
-3.2 |
0.309 |
3 |
0 |
0 |
0.067 |
Average: |
290.5 |
-3.0 |
0.323 |
3 |
0 |
0 |
0.067 |
7 |
9 |
|
[H4B]B:502 |
17 |
1 |
397 |
f |
B |
x,y,z |
1_555 |
26 |
9 |
19835 |
173.0 |
2.4 |
0.498 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]A:502 |
17 |
1 |
398 |
f |
A |
x,y,z |
1_555 |
25 |
8 |
19814 |
171.1 |
2.3 |
0.523 |
2 |
0 |
0 |
0.000 |
Average: |
172.0 |
2.3 |
0.511 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
[Q14]A:503 |
18 |
1 |
620 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
31 |
1 |
826 |
160.0 |
-6.0 |
0.576 |
1 |
0 |
0 |
0.050 |
9 |
12 |
|
[Q14]B:503 |
18 |
1 |
618 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
32 |
1 |
817 |
156.9 |
-6.2 |
0.514 |
1 |
0 |
0 |
0.051 |
10 |
13 |
|
[ACT]B:504 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
19835 |
112.3 |
-1.4 |
0.481 |
2 |
0 |
0 |
0.018 |
11 |
14 |
|
[ACT]A:504 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
19814 |
112.1 |
-1.3 |
0.510 |
2 |
0 |
0 |
0.017 |
12 |
15 |
|
[H4B]A:502 |
13 |
1 |
398 |
◊ |
B |
x,y,z |
1_555 |
23 |
6 |
19835 |
111.7 |
-0.1 |
0.290 |
1 |
0 |
0 |
0.009 |
16 |
|
[H4B]B:502 |
13 |
1 |
397 |
◊ |
A |
x,y,z |
1_555 |
25 |
6 |
19814 |
111.6 |
-0.2 |
0.288 |
1 |
0 |
0 |
0.009 |
Average: |
111.7 |
-0.1 |
0.289 |
1 |
0 |
0 |
0.009 |
13 |
17 |
|
[ACT]A:505 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
19814 |
87.3 |
1.5 |
0.870 |
4 |
0 |
0 |
0.002 |
14 |
18 |
|
B |
12 |
4 |
19835 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
11 |
5 |
19814 |
87.3 |
-0.8 |
0.467 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[ACT]B:505 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
19835 |
87.0 |
1.4 |
0.864 |
3 |
0 |
0 |
0.000 |
16 |
20 |
|
[GOL]B:506 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
19835 |
82.0 |
0.3 |
0.622 |
3 |
0 |
0 |
0.008 |
17 |
21 |
|
[GOL]A:506 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
19814 |
74.8 |
-0.3 |
0.542 |
1 |
0 |
0 |
0.005 |
18 |
22 |
|
[GOL]A:506 |
6 |
1 |
222 |
◊ |
B |
x,y,z |
1_555 |
17 |
3 |
19835 |
67.7 |
-0.2 |
0.577 |
1 |
0 |
0 |
0.005 |
19 |
23 |
|
[GOL]B:506 |
6 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
14 |
3 |
19814 |
54.6 |
0.1 |
0.649 |
0 |
0 |
0 |
0.000 |
20 |
24 |
|
A |
7 |
4 |
19814 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
2 |
19835 |
49.6 |
-0.6 |
0.394 |
0 |
0 |
0 |
0.000 |
21 |
25 |
|
[GOL]A:506 |
4 |
1 |
222 |
f |
[H4B]A:502 |
x,y,z |
1_555 |
6 |
1 |
398 |
42.6 |
0.2 |
0.305 |
3 |
0 |
0 |
0.009 |
22 |
26 |
|
[H4B]B:502 |
4 |
1 |
397 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
6 |
1 |
817 |
40.0 |
-1.0 |
0.511 |
2 |
0 |
0 |
0.029 |
27 |
|
[H4B]A:502 |
4 |
1 |
398 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
5 |
1 |
826 |
39.4 |
-1.3 |
0.441 |
1 |
0 |
0 |
0.029 |
Average: |
39.7 |
-1.2 |
0.476 |
2 |
0 |
0 |
0.029 |
23 |
28 |
|
[GOL]B:506 |
4 |
1 |
221 |
f |
[H4B]B:502 |
x,y,z |
1_555 |
7 |
1 |
397 |
38.1 |
0.1 |
0.288 |
3 |
0 |
0 |
0.009 |
24 |
29 |
|
[GOL]B:506 |
3 |
1 |
221 |
f |
[Q14]B:503 |
x,y,z |
1_555 |
8 |
1 |
618 |
37.9 |
-0.2 |
0.432 |
0 |
0 |
0 |
0.001 |
25 |
30 |
|
[ZN]A:507 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
19814 |
35.0 |
-20.0 |
0.000 |
0 |
0 |
0 |
0.239 |
31 |
|
[ZN]A:507 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
19835 |
34.7 |
-20.5 |
0.000 |
0 |
0 |
0 |
0.239 |
Average: |
34.9 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.239 |
26 |
32 |
|
[ACT]B:504 |
3 |
1 |
183 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
5 |
1 |
817 |
34.5 |
-1.0 |
0.755 |
0 |
0 |
0 |
0.008 |
27 |
33 |
|
[ACT]A:505 |
2 |
1 |
184 |
f |
[Q14]A:503 |
x,y,z |
1_555 |
4 |
1 |
620 |
34.2 |
-0.3 |
0.580 |
0 |
0 |
0 |
0.002 |
28 |
34 |
|
[ACT]A:504 |
3 |
1 |
183 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
5 |
1 |
826 |
34.1 |
-1.1 |
0.755 |
0 |
0 |
0 |
0.008 |
29 |
35 |
|
B |
6 |
2 |
19835 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
19814 |
33.7 |
0.8 |
0.846 |
0 |
0 |
0 |
0.000 |
30 |
36 |
|
[Q14]A:503 |
4 |
1 |
620 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
19835 |
33.1 |
-0.0 |
0.364 |
0 |
0 |
0 |
0.000 |
31 |
37 |
|
[ACT]B:505 |
1 |
1 |
183 |
f |
[Q14]B:503 |
x,y,z |
1_555 |
4 |
1 |
618 |
33.1 |
-0.5 |
0.379 |
0 |
0 |
0 |
0.004 |
32 |
38 |
|
[Q14]B:503 |
5 |
1 |
618 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
19814 |
32.5 |
0.0 |
0.323 |
0 |
0 |
0 |
0.000 |
33 |
39 |
|
[GOL]A:506 |
3 |
1 |
222 |
f |
[Q14]A:503 |
x,y,z |
1_555 |
8 |
1 |
620 |
29.5 |
0.3 |
0.546 |
0 |
0 |
0 |
0.000 |
34 |
40 |
|
[ACT]B:505 |
1 |
1 |
183 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
1 |
1 |
817 |
14.9 |
-1.0 |
0.341 |
0 |
0 |
0 |
0.008 |
35 |
41 |
|
[ACT]A:505 |
1 |
1 |
184 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
1 |
1 |
826 |
12.1 |
-0.8 |
0.358 |
0 |
0 |
0 |
0.006 |
36 |
42 |
|
[Q14]B:503 |
1 |
1 |
618 |
f |
[H4B]B:502 |
x,y,z |
1_555 |
3 |
1 |
397 |
10.1 |
0.2 |
0.386 |
0 |
0 |
0 |
0.000 |
37 |
43 |
|
[Q14]A:503 |
4 |
1 |
620 |
f |
[H4B]A:502 |
x,y,z |
1_555 |
2 |
1 |
398 |
9.1 |
-0.1 |
0.340 |
0 |
0 |
0 |
0.000 |
38 |
44 |
|
A |
1 |
1 |
19814 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
19814 |
6.7 |
0.2 |
0.822 |
0 |
0 |
0 |
0.000 |
39 |
45 |
|
[GOL]B:506 |
1 |
1 |
221 |
f |
[ACT]B:505 |
x,y,z |
1_555 |
1 |
1 |
183 |
1.4 |
-0.0 |
0.500 |
0 |
0 |
0 |
0.000 |
|