| ## |
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 |
100 |
31 |
17253 |
◊ |
B |
x-1,y,z |
1_455 |
103 |
32 |
17139 |
954.7 |
0.8 |
0.810 |
15 |
25 |
0 |
0.000 |
| 2 |
2 |
|
[HEM]B:501 |
43 |
1 |
838 |
f |
B |
x,y,z |
1_555 |
76 |
36 |
17139 |
578.7 |
-24.3 |
0.126 |
6 |
0 |
0 |
0.088 |
3 |
|
[HEM]A:501 |
43 |
1 |
831 |
f |
A |
x,y,z |
1_555 |
77 |
34 |
17253 |
578.0 |
-24.5 |
0.101 |
6 |
0 |
0 |
0.088 |
| Average: |
578.3 |
-24.4 |
0.113 |
6 |
0 |
0 |
0.088 |
| 3 |
4 |
|
A |
59 |
21 |
17253 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
59 |
18 |
17139 |
534.4 |
0.3 |
0.735 |
10 |
7 |
0 |
0.006 |
| 4 |
5 |
|
B |
65 |
18 |
17139 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
51 |
13 |
17253 |
496.7 |
-4.1 |
0.300 |
3 |
2 |
0 |
0.000 |
6 |
|
B |
49 |
14 |
17139 |
◊ |
A |
-x+3/2,-y,z-1/2 |
2_654 |
55 |
12 |
17253 |
478.3 |
-5.0 |
0.205 |
3 |
1 |
0 |
0.000 |
| Average: |
487.5 |
-4.5 |
0.252 |
3 |
2 |
0 |
0.000 |
| 5 |
7 |
|
B |
41 |
13 |
17139 |
◊ |
A |
x,y,z |
1_555 |
36 |
13 |
17253 |
307.7 |
-2.3 |
0.438 |
0 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[CNL]A:502 |
9 |
1 |
307 |
f |
A |
x,y,z |
1_555 |
21 |
14 |
17253 |
172.2 |
6.0 |
0.277 |
1 |
0 |
0 |
0.000 |
9 |
|
[CNL]B:502 |
9 |
1 |
309 |
f |
B |
x,y,z |
1_555 |
21 |
14 |
17139 |
171.9 |
6.0 |
0.282 |
1 |
0 |
0 |
0.000 |
| Average: |
172.1 |
6.0 |
0.279 |
1 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[PGE]A:504 |
9 |
1 |
322 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
17253 |
139.9 |
3.2 |
0.240 |
0 |
0 |
0 |
0.000 |
| 8 |
11 |
|
[PGE]B:505 |
9 |
1 |
325 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
17139 |
135.7 |
3.6 |
0.273 |
2 |
0 |
0 |
0.000 |
| 9 |
12 |
|
B |
15 |
5 |
17139 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
14 |
6 |
17253 |
124.5 |
2.8 |
0.930 |
2 |
0 |
0 |
0.000 |
| 10 |
13 |
|
B |
11 |
5 |
17139 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
9 |
3 |
17139 |
98.9 |
1.2 |
0.663 |
1 |
1 |
0 |
0.000 |
| 11 |
14 |
|
[SO4]B:504 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
17139 |
92.7 |
-12.9 |
0.788 |
3 |
0 |
0 |
0.031 |
| 12 |
15 |
|
[SO4]B:503 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
17139 |
88.6 |
-12.7 |
0.871 |
4 |
0 |
0 |
0.032 |
| 13 |
16 |
|
[SO4]A:503 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
17253 |
84.2 |
-11.9 |
0.893 |
4 |
0 |
0 |
0.045 |
| 14 |
17 |
|
[CNL]B:502 |
6 |
1 |
309 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
24 |
1 |
838 |
80.1 |
1.5 |
0.209 |
0 |
0 |
0 |
0.000 |
18 |
|
[CNL]A:502 |
6 |
1 |
307 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
25 |
1 |
831 |
79.0 |
1.4 |
0.149 |
0 |
0 |
0 |
0.000 |
| Average: |
79.6 |
1.5 |
0.179 |
0 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[SO4]A:503 |
4 |
1 |
186 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
6 |
4 |
17139 |
55.8 |
-6.7 |
0.818 |
2 |
0 |
0 |
0.008 |
| 16 |
20 |
|
[SO4]B:504 |
3 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
17253 |
30.7 |
-3.3 |
0.894 |
1 |
0 |
0 |
0.000 |
|