## |
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 |
|
A |
219 |
61 |
20072 |
◊ |
A |
-x+y+1,y,-z+1/2 |
11_655 |
219 |
61 |
20072 |
2231.4 |
-31.3 |
0.009 |
26 |
18 |
0 |
0.228 |
2 |
|
B |
216 |
62 |
19699 |
◊ |
B |
-x+2,-x+y+1,-z+5/3 |
9_766 |
212 |
62 |
19699 |
2128.5 |
-25.3 |
0.047 |
30 |
12 |
0 |
0.228 |
Average: |
2179.9 |
-28.3 |
0.028 |
28 |
15 |
0 |
0.228 |
2 |
3 |
|
[HEM]B:1901 |
43 |
1 |
814 |
f |
B |
x,y,z |
1_555 |
81 |
25 |
19699 |
562.2 |
-19.5 |
0.290 |
1 |
0 |
0 |
0.225 |
4 |
|
[HEM]A:901 |
43 |
1 |
817 |
f |
A |
x,y,z |
1_555 |
82 |
25 |
20072 |
548.5 |
-18.6 |
0.309 |
1 |
0 |
0 |
0.225 |
Average: |
555.3 |
-19.1 |
0.299 |
1 |
0 |
0 |
0.225 |
3 |
5 |
|
B |
46 |
13 |
19699 |
◊ |
B |
-x+y+1,y,-z+3/2 |
11_656 |
46 |
13 |
19699 |
437.2 |
-2.5 |
0.492 |
2 |
0 |
0 |
0.014 |
6 |
|
A |
46 |
13 |
20072 |
◊ |
A |
-x+2,-x+y+1,-z+2/3 |
9_765 |
45 |
13 |
20072 |
432.9 |
-2.6 |
0.479 |
2 |
0 |
0 |
0.014 |
Average: |
435.1 |
-2.5 |
0.485 |
2 |
0 |
0 |
0.014 |
4 |
7 |
|
[A11]A:906 |
19 |
1 |
486 |
f |
A |
x,y,z |
1_555 |
43 |
17 |
20072 |
282.3 |
-3.4 |
0.577 |
3 |
0 |
0 |
0.054 |
8 |
|
[A11]B:1906 |
19 |
1 |
486 |
f |
B |
x,y,z |
1_555 |
42 |
17 |
19699 |
280.7 |
-3.5 |
0.578 |
3 |
0 |
0 |
0.054 |
Average: |
281.5 |
-3.4 |
0.577 |
3 |
0 |
0 |
0.054 |
5 |
9 |
|
B |
32 |
12 |
19699 |
◊ |
A |
x,x-y,-z+7/6 |
12_556 |
35 |
9 |
20072 |
280.7 |
-3.9 |
0.247 |
2 |
0 |
0 |
0.000 |
6 |
10 |
|
[H4B]A:902 |
17 |
1 |
393 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
20072 |
212.2 |
1.4 |
0.385 |
2 |
0 |
0 |
0.000 |
11 |
|
[H4B]B:1902 |
17 |
1 |
398 |
f |
B |
x,y,z |
1_555 |
31 |
9 |
19699 |
206.0 |
1.7 |
0.422 |
2 |
0 |
0 |
0.000 |
Average: |
209.1 |
1.5 |
0.404 |
2 |
0 |
0 |
0.000 |
7 |
12 |
|
[BOG]A:4001 |
17 |
1 |
531 |
f |
A |
x,y,z |
1_555 |
26 |
10 |
20072 |
211.1 |
1.4 |
0.082 |
1 |
0 |
0 |
0.000 |
8 |
13 |
|
[BOG]B:4002 |
16 |
1 |
520 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
19699 |
169.7 |
0.4 |
0.053 |
1 |
0 |
0 |
0.000 |
9 |
14 |
|
B |
22 |
7 |
19699 |
◊ |
A |
x,y,z |
1_555 |
22 |
7 |
20072 |
164.8 |
-3.7 |
0.172 |
0 |
0 |
0 |
0.000 |
10 |
15 |
|
[H4B]B:1902 |
14 |
1 |
398 |
◊ |
B |
-x+2,-x+y+1,-z+5/3 |
9_766 |
22 |
6 |
19699 |
118.2 |
0.0 |
0.257 |
1 |
0 |
0 |
0.005 |
16 |
|
[H4B]A:902 |
14 |
1 |
393 |
◊ |
A |
-x+y+1,y,-z+1/2 |
11_655 |
23 |
6 |
20072 |
116.0 |
-0.1 |
0.243 |
1 |
0 |
0 |
0.005 |
Average: |
117.1 |
-0.1 |
0.250 |
1 |
0 |
0 |
0.005 |
11 |
17 |
|
[A11]B:1906 |
11 |
1 |
486 |
f |
[HEM]B:1901 |
x,y,z |
1_555 |
31 |
1 |
814 |
116.3 |
-3.8 |
0.702 |
0 |
0 |
0 |
0.043 |
18 |
|
[A11]A:906 |
11 |
1 |
486 |
f |
[HEM]A:901 |
x,y,z |
1_555 |
31 |
1 |
817 |
111.2 |
-3.6 |
0.692 |
0 |
0 |
0 |
0.043 |
Average: |
113.7 |
-3.7 |
0.697 |
0 |
0 |
0 |
0.043 |
12 |
19 |
|
[SO4]A:3003 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
20072 |
114.5 |
-15.9 |
0.855 |
2 |
0 |
0 |
0.138 |
13 |
20 |
|
[SO4]A:3006 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
20072 |
109.8 |
-17.5 |
0.517 |
2 |
0 |
0 |
0.151 |
14 |
21 |
|
[BOG]B:4002 |
10 |
1 |
520 |
◊ |
A |
x,x-y,-z+7/6 |
12_556 |
10 |
5 |
20072 |
106.6 |
3.8 |
0.506 |
0 |
0 |
0 |
0.000 |
15 |
22 |
|
[SO4]B:3009 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
19699 |
100.1 |
-14.2 |
0.771 |
2 |
0 |
0 |
0.171 |
16 |
23 |
|
[SO4]A:3007 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
20072 |
97.8 |
-14.3 |
0.774 |
2 |
0 |
0 |
0.125 |
17 |
24 |
|
[SO4]A:3001 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
20072 |
78.5 |
-11.3 |
0.798 |
5 |
0 |
0 |
0.111 |
18 |
25 |
|
[SO4]B:3005 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
19699 |
76.8 |
-10.6 |
0.898 |
2 |
0 |
0 |
0.129 |
19 |
26 |
|
[SO4]B:3004 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
19699 |
74.0 |
-8.2 |
0.955 |
3 |
0 |
0 |
0.108 |
20 |
27 |
|
[SO4]A:3002 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
20072 |
73.4 |
-8.2 |
0.946 |
4 |
0 |
0 |
0.082 |
21 |
28 |
|
A |
5 |
3 |
20072 |
◊ |
B |
x,y,z-1 |
1_554 |
7 |
3 |
19699 |
68.0 |
2.1 |
0.910 |
2 |
0 |
0 |
0.000 |
22 |
29 |
|
[SO4]A:3008 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
20072 |
50.9 |
-5.1 |
0.938 |
3 |
0 |
0 |
0.053 |
23 |
30 |
|
[SO4]A:3008 |
4 |
1 |
186 |
◊ |
A |
-x+2,-x+y+1,-z+2/3 |
9_765 |
7 |
4 |
20072 |
49.3 |
-5.7 |
0.816 |
1 |
0 |
0 |
0.051 |
24 |
31 |
|
[H4B]A:902 |
4 |
1 |
393 |
f |
[HEM]A:901 |
x,y,z |
1_555 |
5 |
1 |
817 |
41.8 |
-1.3 |
0.442 |
1 |
0 |
0 |
0.025 |
32 |
|
[H4B]B:1902 |
4 |
1 |
398 |
f |
[HEM]B:1901 |
x,y,z |
1_555 |
5 |
1 |
814 |
41.3 |
-1.4 |
0.451 |
2 |
0 |
0 |
0.025 |
Average: |
41.6 |
-1.4 |
0.446 |
2 |
0 |
0 |
0.025 |
25 |
33 |
|
A |
5 |
1 |
20072 |
◊ |
A |
x,x-y,-z+1/6 |
12_555 |
5 |
1 |
20072 |
37.8 |
0.3 |
0.728 |
0 |
0 |
0 |
0.000 |
26 |
34 |
|
[HEM]A:901 |
5 |
1 |
817 |
f |
[SO4]A:3006 |
x,y,z |
1_555 |
4 |
1 |
186 |
37.6 |
-5.0 |
0.968 |
0 |
0 |
0 |
0.041 |
27 |
35 |
|
[BOG]B:4002 |
1 |
1 |
520 |
◊ |
[BOG]A:4001 |
x,x-y,-z+7/6 |
12_556 |
2 |
1 |
531 |
22.8 |
1.5 |
0.584 |
0 |
0 |
0 |
0.000 |
28 |
36 |
|
[SO4]A:3002 |
2 |
1 |
186 |
◊ |
A |
-x+y+1,y,-z+1/2 |
11_655 |
1 |
1 |
20072 |
17.0 |
-1.3 |
0.967 |
1 |
0 |
0 |
0.013 |
29 |
37 |
|
[SO4]B:3004 |
1 |
1 |
187 |
◊ |
B |
-x+2,-x+y+1,-z+5/3 |
9_766 |
1 |
1 |
19699 |
13.0 |
-1.1 |
0.875 |
0 |
0 |
0 |
0.012 |
30 |
38 |
|
[SO4]B:3005 |
1 |
1 |
186 |
f |
[SO4]B:3004 |
x,y,z |
1_555 |
1 |
1 |
187 |
3.0 |
-0.7 |
1.000 |
0 |
0 |
0 |
0.008 |
31 |
39 |
|
[SO4]A:3002 |
1 |
1 |
186 |
f |
[SO4]A:3001 |
x,y,z |
1_555 |
1 |
1 |
185 |
2.6 |
-0.6 |
1.000 |
0 |
0 |
0 |
0.005 |
|