| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
245 |
65 |
21754 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
242 |
65 |
21754 |
2371.3 |
-29.2 |
0.099 |
22 |
0 |
0 |
0.713 |
2 |
|
B |
124 |
39 |
9115 |
◊ |
A |
x,y,z |
1_555 |
147 |
42 |
21754 |
1363.0 |
-14.3 |
0.352 |
15 |
2 |
0 |
0.390 |
3 |
|
C |
117 |
9 |
4656 |
◊ |
A |
x,y,z |
1_555 |
119 |
40 |
21754 |
1099.6 |
-6.6 |
0.815 |
20 |
0 |
0 |
0.397 |
4 |
|
T |
89 |
18 |
4340 |
◊ |
T |
-y,-x,-z-1/2 |
8_554 |
88 |
18 |
4340 |
857.7 |
-6.0 |
0.794 |
44 |
0 |
0 |
1.000 |
5 |
|
C |
80 |
16 |
4656 |
◊ |
D |
x,y,z |
1_555 |
81 |
17 |
3934 |
735.6 |
-7.8 |
0.742 |
40 |
0 |
0 |
1.000 |
6 |
|
C |
66 |
7 |
4656 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
67 |
21 |
21754 |
597.1 |
-10.2 |
0.475 |
13 |
0 |
0 |
0.273 |
7 |
|
D |
68 |
11 |
3934 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
67 |
24 |
21754 |
579.8 |
-4.6 |
0.648 |
10 |
0 |
0 |
0.228 |
8 |
|
T |
43 |
6 |
4340 |
◊ |
A |
x,y,z |
1_555 |
54 |
21 |
21754 |
457.5 |
-6.5 |
0.443 |
9 |
0 |
0 |
0.271 |
9 |
|
D |
35 |
7 |
3934 |
◊ |
A |
x,y,z |
1_555 |
45 |
14 |
21754 |
337.9 |
-1.8 |
0.687 |
2 |
0 |
0 |
0.068 |
10 |
|
T |
36 |
7 |
4340 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
33 |
13 |
21754 |
296.5 |
-6.0 |
0.420 |
3 |
0 |
0 |
0.125 |
11 |
|
B |
29 |
13 |
9115 |
◊ |
D |
-y+1/2,x+1/2,z+1/4 |
3_555 |
27 |
4 |
3934 |
238.7 |
-4.1 |
0.465 |
2 |
0 |
0 |
0.079 |
12 |
|
B |
31 |
10 |
9115 |
◊ |
C |
-y+1/2,x+1/2,z+1/4 |
3_555 |
25 |
3 |
4656 |
235.4 |
-2.9 |
0.634 |
4 |
0 |
0 |
0.080 |
13 |
|
A |
22 |
5 |
21754 |
◊ |
B |
x-1/2,-y+1/2,-z-1/4 |
6_454 |
14 |
5 |
9115 |
155.0 |
-2.6 |
0.361 |
1 |
0 |
0 |
0.052 |
14 |
|
[SO4]B:402 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
19 |
5 |
9115 |
118.7 |
-19.2 |
0.716 |
5 |
0 |
0 |
0.392 |
15 |
|
[PGE]T:101 |
8 |
1 |
331 |
f |
T |
-y,-x,-z-1/2 |
8_554 |
14 |
2 |
4340 |
96.5 |
4.2 |
0.299 |
0 |
0 |
0 |
0.000 |
16 |
|
[PGE]T:101 |
7 |
1 |
331 |
◊ |
T |
x,y,z |
1_555 |
14 |
2 |
4340 |
96.0 |
4.4 |
0.387 |
0 |
0 |
0 |
0.000 |
17 |
|
T |
9 |
2 |
4340 |
◊ |
D |
x,y,z |
1_555 |
8 |
1 |
3934 |
76.8 |
-1.5 |
0.461 |
0 |
0 |
0 |
0.022 |
18 |
|
[MN]B:401 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
9115 |
62.7 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.074 |
19 |
|
[MN]A:403 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
21754 |
44.1 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.103 |
20 |
|
[MN]A:403 |
1 |
1 |
123 |
◊ |
T |
x,y,z |
1_555 |
6 |
2 |
4340 |
38.7 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.071 |
21 |
|
[MN]A:402 |
1 |
1 |
123 |
◊ |
A |
x,y,z |
1_555 |
8 |
5 |
21754 |
38.7 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.064 |
22 |
|
[MN]B:401 |
1 |
1 |
123 |
◊ |
C |
-y+1/2,x+1/2,z+1/4 |
3_555 |
4 |
1 |
4656 |
35.0 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.037 |
23 |
|
[MN]A:402 |
1 |
1 |
123 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
3934 |
33.1 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.034 |
24 |
|
[MN]A:402 |
1 |
1 |
123 |
f |
T |
x,y,z |
1_555 |
4 |
1 |
4340 |
29.5 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.372 |
25 |
|
[MN]A:403 |
1 |
1 |
123 |
◊ |
[MN]A:402 |
x,y,z |
1_555 |
1 |
1 |
123 |
15.3 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.039 |
26 |
|
[ZN]A:401 |
1 |
1 |
98 |
f |
A |
-y,-x,-z-1/2 |
8_554 |
2 |
1 |
21754 |
11.4 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.185 |
27 |
|
[MN]A:403 |
1 |
1 |
123 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
3934 |
7.9 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.014 |
|