| ## |
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 |
51 |
18 |
6455 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
51 |
18 |
6455 |
550.5 |
3.8 |
0.788 |
18 |
0 |
0 |
0.000 |
2 |
|
A |
49 |
11 |
6455 |
◊ |
A |
y,x,-z-1 |
7_554 |
50 |
11 |
6455 |
368.2 |
-1.2 |
0.357 |
2 |
0 |
0 |
0.000 |
3 |
|
A |
30 |
11 |
6455 |
x |
A |
-y-1/2,x+1/2,z-1/4 |
3_454 |
35 |
14 |
6455 |
287.2 |
2.5 |
0.743 |
5 |
0 |
0 |
0.000 |
4 |
|
A |
22 |
6 |
6455 |
x |
A |
-y-1/2,x+1/2,z+3/4 |
3_455 |
22 |
8 |
6455 |
197.7 |
0.4 |
0.445 |
2 |
0 |
0 |
0.000 |
5 |
|
A |
18 |
5 |
6455 |
◊ |
[1PT]A:214 |
-y-1/2,x+1/2,z+3/4 |
3_455 |
9 |
1 |
285 |
113.9 |
2.1 |
0.555 |
0 |
0 |
0 |
0.000 |
6 |
|
[EDO]A:201 |
4 |
1 |
180 |
f |
A |
x,y,z |
1_555 |
22 |
10 |
6455 |
100.8 |
3.2 |
0.434 |
4 |
0 |
0 |
0.000 |
7 |
|
[CPT]A:215 |
3 |
1 |
206 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
6455 |
96.5 |
-12.7 |
0.783 |
1 |
0 |
0 |
0.374 |
8 |
|
[NO3]A:203 |
4 |
1 |
163 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
6455 |
94.2 |
1.2 |
0.467 |
4 |
0 |
0 |
0.016 |
9 |
|
[NO3]A:206 |
4 |
1 |
165 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
6455 |
92.0 |
1.6 |
0.558 |
3 |
0 |
0 |
0.000 |
10 |
|
[NO3]A:204 |
4 |
1 |
162 |
◊ |
A |
x,y,z |
1_555 |
12 |
8 |
6455 |
88.0 |
1.8 |
0.608 |
4 |
0 |
0 |
0.000 |
11 |
|
[EDO]A:202 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
15 |
3 |
6455 |
82.3 |
2.3 |
0.363 |
0 |
0 |
0 |
0.000 |
12 |
|
[NO3]A:210 |
4 |
1 |
167 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
6455 |
80.8 |
1.4 |
0.581 |
3 |
0 |
0 |
0.000 |
13 |
|
[NO3]A:208 |
4 |
1 |
165 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
6455 |
79.7 |
1.1 |
0.414 |
2 |
0 |
0 |
0.000 |
14 |
|
[NO3]A:211 |
4 |
1 |
165 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
6455 |
79.3 |
0.8 |
0.398 |
1 |
0 |
0 |
0.000 |
15 |
|
[NO3]A:205 |
4 |
1 |
164 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
6455 |
78.3 |
1.1 |
0.442 |
1 |
0 |
0 |
0.000 |
16 |
|
[1PT]A:214 |
5 |
1 |
285 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
6455 |
76.2 |
-7.8 |
0.557 |
0 |
0 |
0 |
0.222 |
17 |
|
[NO3]A:207 |
4 |
1 |
166 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
6455 |
72.3 |
0.9 |
0.396 |
1 |
0 |
0 |
0.000 |
18 |
|
A |
6 |
2 |
6455 |
◊ |
A |
-y,-x,-z+1/2 |
8_555 |
6 |
2 |
6455 |
66.2 |
-1.6 |
0.128 |
0 |
0 |
0 |
0.000 |
19 |
|
[NA]A:212 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
6455 |
61.0 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.203 |
20 |
|
A |
11 |
6 |
6455 |
x |
A |
x,y,z-1 |
1_554 |
4 |
1 |
6455 |
47.7 |
0.6 |
0.611 |
0 |
0 |
0 |
0.000 |
21 |
|
[NO3]A:209 |
4 |
1 |
165 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
6455 |
47.1 |
0.7 |
0.440 |
2 |
0 |
0 |
0.000 |
22 |
|
[NO3]A:209 |
4 |
1 |
165 |
f |
A |
y,x,-z-1 |
7_554 |
12 |
4 |
6455 |
46.8 |
0.6 |
0.436 |
3 |
0 |
0 |
0.020 |
23 |
|
[NO3]A:209 |
4 |
1 |
165 |
◊ |
[NO3]A:209 |
y,x,-z-1 |
7_554 |
4 |
1 |
165 |
45.3 |
1.0 |
0.320 |
0 |
0 |
0 |
0.000 |
24 |
|
A |
9 |
4 |
6455 |
f |
[NA]A:213 |
-y-1/2,x+1/2,z-1/4 |
3_454 |
1 |
1 |
125 |
43.4 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.158 |
25 |
|
[NA]A:213 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
11 |
6 |
6455 |
38.2 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.000 |
26 |
|
[NA]A:212 |
1 |
1 |
125 |
f |
[NO3]A:210 |
x,y,z |
1_555 |
3 |
1 |
167 |
35.5 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.112 |
27 |
|
A |
4 |
2 |
6455 |
◊ |
[NO3]A:207 |
-y-1/2,x+1/2,z-1/4 |
3_454 |
4 |
1 |
166 |
34.1 |
0.2 |
0.651 |
1 |
0 |
0 |
0.000 |
28 |
|
[NO3]A:211 |
3 |
1 |
165 |
◊ |
A |
y,x,-z-1 |
7_554 |
5 |
1 |
6455 |
31.8 |
0.3 |
0.665 |
0 |
0 |
0 |
0.000 |
29 |
|
[NO3]A:210 |
3 |
1 |
167 |
f |
[EDO]A:201 |
x,y,z |
1_555 |
3 |
1 |
180 |
30.0 |
1.3 |
1.000 |
0 |
0 |
0 |
0.000 |
30 |
|
[NA]A:213 |
1 |
1 |
125 |
◊ |
[NO3]A:207 |
x,y,z |
1_555 |
3 |
1 |
166 |
27.3 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
31 |
|
[CPT]A:215 |
2 |
1 |
206 |
◊ |
A |
y,x,-z-1 |
7_554 |
1 |
1 |
6455 |
22.8 |
-1.2 |
0.945 |
0 |
0 |
0 |
0.000 |
32 |
|
[CPT]A:215 |
1 |
1 |
206 |
◊ |
[NO3]A:211 |
y,x,-z-1 |
7_554 |
3 |
1 |
165 |
20.1 |
0.5 |
1.000 |
1 |
0 |
0 |
0.000 |
33 |
|
[NO3]A:205 |
3 |
1 |
164 |
f |
[EDO]A:202 |
x,y,z |
1_555 |
1 |
1 |
184 |
18.8 |
0.4 |
1.000 |
1 |
0 |
0 |
0.000 |
34 |
|
A |
4 |
1 |
6455 |
f |
[NO3]A:211 |
-y-1/2,x+1/2,z+3/4 |
3_455 |
1 |
1 |
165 |
13.3 |
-0.0 |
0.639 |
0 |
0 |
0 |
0.000 |
35 |
|
[NO3]A:205 |
1 |
1 |
164 |
f |
A |
x,y,z-1 |
1_554 |
1 |
1 |
6455 |
8.2 |
0.4 |
0.942 |
0 |
0 |
0 |
0.000 |
36 |
|
[NO3]A:209 |
1 |
1 |
165 |
◊ |
[NO3]A:204 |
y,x,-z-1 |
7_554 |
1 |
1 |
162 |
7.5 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
37 |
|
[NO3]A:209 |
1 |
1 |
165 |
◊ |
[NO3]A:204 |
x,y,z |
1_555 |
1 |
1 |
162 |
7.3 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
38 |
|
[NA]A:212 |
1 |
1 |
125 |
f |
[EDO]A:201 |
x,y,z |
1_555 |
1 |
1 |
180 |
6.5 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.014 |
39 |
|
[NO3]A:204 |
2 |
1 |
162 |
◊ |
A |
y,x,-z-1 |
7_554 |
1 |
1 |
6455 |
4.7 |
0.1 |
0.876 |
0 |
0 |
0 |
0.000 |
40 |
|
A |
2 |
1 |
6455 |
x |
A |
-x-1/2,y-1/2,-z-1/4 |
5_444 |
1 |
1 |
6455 |
3.9 |
0.0 |
0.500 |
0 |
0 |
0 |
0.000 |
41 |
|
[NO3]A:208 |
1 |
1 |
165 |
f |
A |
-y,-x,-z-1/2 |
8_554 |
1 |
1 |
6455 |
0.8 |
0.0 |
0.796 |
0 |
0 |
0 |
0.000 |
|