| ## |
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 |
82 |
25 |
8703 |
◊ |
A |
x-y,-y,-z+1/3 |
5_555 |
82 |
25 |
8703 |
744.0 |
1.4 |
0.604 |
14 |
16 |
0 |
0.000 |
| 2 |
2 |
|
A |
48 |
12 |
8703 |
x |
A |
-y+1,x-y,z-1/3 |
2_654 |
39 |
13 |
8703 |
378.1 |
1.7 |
0.681 |
8 |
0 |
0 |
0.000 |
| 3 |
3 |
|
A |
49 |
16 |
8703 |
x |
A |
y,x-1,-z |
4_545 |
39 |
11 |
8703 |
356.6 |
1.3 |
0.631 |
3 |
4 |
0 |
0.000 |
| 4 |
4 |
|
A |
9 |
3 |
8703 |
◊ |
A |
-x+2,-x+y+1,-z+2/3 |
6_765 |
9 |
3 |
8703 |
93.2 |
0.9 |
0.733 |
2 |
0 |
0 |
0.000 |
| 5 |
5 |
|
[XE]A:500 |
1 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
20 |
11 |
8703 |
72.0 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.014 |
6 |
|
[XE]A:502 |
1 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
16 |
12 |
8703 |
65.4 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.014 |
| Average: |
68.7 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.014 |
| 6 |
7 |
|
[BME]A:901 |
4 |
1 |
207 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
8703 |
66.2 |
-0.5 |
0.381 |
1 |
0 |
0 |
0.000 |
| 7 |
8 |
|
[BME]A:903 |
4 |
1 |
207 |
◊ |
A |
x,y,z |
1_555 |
16 |
8 |
8703 |
64.8 |
0.8 |
0.469 |
1 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[XE]A:501 |
1 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
11 |
9 |
8703 |
64.3 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.006 |
| 9 |
10 |
|
[CL]A:173 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
8703 |
60.8 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.041 |
| 10 |
11 |
|
[CL]A:178 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
8703 |
57.4 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.032 |
| 11 |
12 |
|
[BME]A:903 |
3 |
1 |
207 |
◊ |
A |
x-y,-y,-z+1/3 |
5_555 |
15 |
5 |
8703 |
56.0 |
-1.3 |
0.367 |
0 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[BME]A:901 |
4 |
1 |
207 |
◊ |
A |
x-y,-y,-z+1/3 |
5_555 |
10 |
5 |
8703 |
54.5 |
-0.1 |
0.431 |
1 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[BME]A:902 |
4 |
1 |
207 |
◊ |
A |
x-y,-y,-z+1/3 |
5_555 |
13 |
6 |
8703 |
46.2 |
-0.6 |
0.282 |
0 |
0 |
0 |
0.000 |
| 14 |
15 |
|
A |
10 |
4 |
8703 |
◊ |
[CL]A:178 |
-y+1,x-y,z-1/3 |
2_654 |
1 |
1 |
125 |
45.6 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 15 |
16 |
|
[BME]A:902 |
4 |
1 |
207 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
8703 |
43.4 |
-0.3 |
0.361 |
0 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[BME]A:902 |
4 |
1 |
207 |
f |
[BME]A:902 |
x-y,-y,-z+1/3 |
5_555 |
4 |
1 |
207 |
40.8 |
1.7 |
0.684 |
0 |
0 |
0 |
0.000 |
| 17 |
18 |
|
[XE]A:502 |
1 |
1 |
159 |
f |
[XE]A:501 |
x,y,z |
1_555 |
1 |
1 |
159 |
33.2 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.003 |
| 18 |
19 |
|
A |
5 |
2 |
8703 |
◊ |
[CL]A:173 |
y,x-1,-z |
4_545 |
1 |
1 |
125 |
33.1 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 19 |
20 |
|
[XE]A:502 |
1 |
1 |
159 |
f |
[XE]A:500 |
x,y,z |
1_555 |
1 |
1 |
159 |
31.3 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.003 |
| 20 |
21 |
|
[BME]A:903 |
3 |
1 |
207 |
f |
[BME]A:902 |
x,y,z |
1_555 |
3 |
1 |
207 |
30.8 |
-1.7 |
0.203 |
0 |
0 |
0 |
0.059 |
| 21 |
22 |
|
[BME]A:901 |
3 |
1 |
207 |
f |
[BME]A:901 |
x-y,-y,-z+1/3 |
5_555 |
3 |
1 |
207 |
30.7 |
-1.6 |
0.203 |
1 |
0 |
0 |
0.035 |
| 22 |
23 |
|
[BME]A:903 |
2 |
1 |
207 |
f |
[BME]A:902 |
x-y,-y,-z+1/3 |
5_555 |
3 |
1 |
207 |
20.8 |
-0.6 |
0.503 |
1 |
0 |
0 |
0.037 |
| 23 |
24 |
|
[BME]A:902 |
2 |
1 |
207 |
f |
[BME]A:901 |
x-y,-y,-z+1/3 |
5_555 |
3 |
1 |
207 |
17.3 |
-0.1 |
0.503 |
1 |
0 |
0 |
0.017 |
| 24 |
25 |
|
[XE]A:501 |
1 |
1 |
159 |
f |
[XE]A:500 |
x,y,z |
1_555 |
1 |
1 |
159 |
13.9 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.001 |
| 25 |
26 |
|
[BME]A:903 |
3 |
1 |
207 |
f |
[BME]A:901 |
x-y,-y,-z+1/3 |
5_555 |
2 |
1 |
207 |
10.9 |
0.2 |
0.503 |
0 |
0 |
0 |
0.000 |
| 26 |
27 |
|
[BME]A:902 |
4 |
1 |
207 |
f |
[BME]A:901 |
x,y,z |
1_555 |
3 |
1 |
207 |
9.4 |
0.3 |
0.463 |
0 |
0 |
0 |
0.000 |
|