## |
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 |
|
B |
172 |
46 |
14792 |
◊ |
B |
-x,y,-z+1 |
2_556 |
170 |
46 |
14792 |
1605.1 |
-11.2 |
0.254 |
24 |
10 |
0 |
0.019 |
2 |
|
B |
136 |
38 |
14792 |
◊ |
A |
x,y,z |
1_555 |
127 |
38 |
11205 |
1254.8 |
-7.5 |
0.424 |
21 |
2 |
0 |
0.214 |
3 |
|
B |
60 |
15 |
14792 |
◊ |
B |
-x,y,-z |
2_555 |
60 |
15 |
14792 |
513.2 |
-1.2 |
0.617 |
18 |
4 |
0 |
0.000 |
4 |
|
B |
41 |
14 |
14792 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
34 |
10 |
11205 |
337.1 |
-1.3 |
0.549 |
3 |
0 |
0 |
0.000 |
5 |
|
A |
30 |
8 |
11205 |
x |
A |
-x+1/2,y-1/2,-z |
4_545 |
26 |
8 |
11205 |
267.1 |
-1.2 |
0.569 |
3 |
4 |
0 |
0.000 |
6 |
|
[BZI]A:601 |
9 |
1 |
263 |
f |
A |
x,y,z |
1_555 |
26 |
13 |
11205 |
177.9 |
4.8 |
0.413 |
0 |
0 |
0 |
0.000 |
7 |
|
[BZI]B:803 |
9 |
1 |
260 |
f |
B |
x,y,z |
1_555 |
29 |
15 |
14792 |
163.2 |
5.1 |
0.459 |
1 |
0 |
0 |
0.000 |
8 |
|
[DMS]A:604 |
4 |
1 |
207 |
f |
A |
x,y,z |
1_555 |
28 |
11 |
11205 |
134.8 |
2.0 |
0.539 |
0 |
0 |
0 |
0.000 |
9 |
|
[EDO]A:602 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
11205 |
116.6 |
2.7 |
0.419 |
1 |
0 |
0 |
0.000 |
10 |
|
[CS]B:811 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
14792 |
114.3 |
-31.6 |
0.000 |
0 |
0 |
0 |
0.395 |
11 |
|
[CS]B:812 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
13 |
10 |
14792 |
110.8 |
-41.4 |
0.000 |
0 |
0 |
0 |
0.518 |
12 |
|
[DMS]B:809 |
4 |
1 |
208 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
14792 |
108.3 |
1.2 |
0.302 |
0 |
0 |
0 |
0.000 |
13 |
|
[BZI]B:801 |
9 |
1 |
261 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
14792 |
105.6 |
2.9 |
0.171 |
2 |
0 |
0 |
0.000 |
14 |
|
[PEG]B:804 |
7 |
1 |
263 |
◊ |
B |
-x,y,-z+1 |
2_556 |
17 |
5 |
14792 |
105.0 |
2.1 |
0.261 |
0 |
0 |
0 |
0.000 |
15 |
|
[PEG]B:804 |
7 |
1 |
263 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
14792 |
104.9 |
2.2 |
0.267 |
1 |
0 |
0 |
0.000 |
16 |
|
[PEG]A:603 |
7 |
1 |
255 |
◊ |
A |
x,y,z |
1_555 |
14 |
4 |
11205 |
98.8 |
2.4 |
0.295 |
0 |
0 |
0 |
0.000 |
17 |
|
[EDO]B:805 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
8 |
14792 |
96.7 |
3.1 |
0.512 |
2 |
0 |
0 |
0.000 |
18 |
|
[DMS]B:810 |
4 |
1 |
208 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
14792 |
80.2 |
0.7 |
0.425 |
1 |
0 |
0 |
0.000 |
19 |
|
[DMS]B:807 |
3 |
1 |
208 |
◊ |
B |
-x,y,-z+1 |
2_556 |
9 |
5 |
14792 |
78.1 |
2.4 |
0.424 |
0 |
0 |
0 |
0.000 |
20 |
|
[DMS]B:807 |
4 |
1 |
208 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
14792 |
75.2 |
-0.1 |
0.328 |
0 |
0 |
0 |
0.002 |
21 |
|
[CL]A:606 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
11205 |
72.1 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.118 |
22 |
|
[DMS]B:808 |
3 |
1 |
206 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
14792 |
69.4 |
2.3 |
0.549 |
0 |
0 |
0 |
0.000 |
23 |
|
[CL]A:605 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
11205 |
69.3 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.123 |
24 |
|
[DMS]B:806 |
3 |
1 |
207 |
◊ |
B |
x,y,z |
1_555 |
12 |
3 |
14792 |
63.6 |
0.6 |
0.279 |
0 |
0 |
0 |
0.000 |
25 |
|
[PEG]A:603 |
3 |
1 |
255 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
14792 |
63.0 |
1.6 |
0.452 |
0 |
0 |
0 |
0.000 |
26 |
|
[DMS]B:808 |
3 |
1 |
206 |
f |
B |
-x,y,-z |
2_555 |
9 |
3 |
14792 |
59.5 |
1.7 |
0.475 |
0 |
0 |
0 |
0.000 |
27 |
|
[DMS]B:810 |
3 |
1 |
208 |
f |
[EDO]B:805 |
x,y,z |
1_555 |
4 |
1 |
184 |
39.5 |
2.0 |
0.451 |
1 |
0 |
0 |
0.000 |
28 |
|
B |
1 |
1 |
14792 |
◊ |
A |
x,y-1,z |
1_545 |
3 |
1 |
11205 |
30.6 |
-0.7 |
0.124 |
0 |
0 |
0 |
0.000 |
29 |
|
[DMS]B:807 |
1 |
1 |
208 |
◊ |
[DMS]B:807 |
-x,y,-z+1 |
2_556 |
1 |
1 |
208 |
28.3 |
1.9 |
0.500 |
0 |
0 |
0 |
0.000 |
30 |
|
[DMS]B:809 |
1 |
1 |
208 |
f |
[EDO]B:805 |
x,y,z |
1_555 |
2 |
1 |
184 |
22.8 |
1.1 |
0.707 |
0 |
0 |
0 |
0.000 |
31 |
|
[DMS]B:810 |
1 |
1 |
208 |
f |
[DMS]B:809 |
x,y,z |
1_555 |
2 |
1 |
208 |
15.7 |
0.9 |
0.468 |
0 |
0 |
0 |
0.000 |
32 |
|
[CS]B:812 |
1 |
1 |
216 |
f |
[BZI]B:803 |
x,y,z |
1_555 |
1 |
1 |
260 |
9.1 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.019 |
33 |
|
[DMS]B:806 |
1 |
1 |
207 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
11205 |
2.2 |
-0.1 |
0.436 |
0 |
0 |
0 |
0.000 |
|