## |
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 |
192 |
55 |
14818 |
x |
A |
z,x,y |
5_555 |
198 |
51 |
14818 |
1748.2 |
-19.0 |
0.084 |
12 |
3 |
0 |
0.476 |
2 |
|
A |
128 |
35 |
14818 |
x |
A |
z+1/2,-x-1/2,-y-1/2 |
18_544 |
140 |
35 |
14818 |
1207.9 |
-7.3 |
0.379 |
16 |
5 |
0 |
0.000 |
3 |
|
A |
76 |
23 |
14818 |
x |
A |
-z-1/2,-x-1/2,y-1/2 |
19_444 |
92 |
24 |
14818 |
756.9 |
-2.6 |
0.523 |
12 |
2 |
0 |
0.000 |
4 |
|
A |
83 |
21 |
14818 |
◊ |
A |
-x,-y,z |
2_555 |
83 |
21 |
14818 |
701.1 |
-2.7 |
0.479 |
12 |
8 |
0 |
0.078 |
5 |
|
A |
57 |
17 |
14818 |
◊ |
A |
-x,-y-1,z |
2_545 |
57 |
17 |
14818 |
498.1 |
-3.2 |
0.394 |
2 |
0 |
0 |
0.056 |
6 |
|
A |
58 |
13 |
14818 |
x |
A |
-z-1/2,x-1/2,-y-1/2 |
20_444 |
59 |
14 |
14818 |
466.9 |
-2.8 |
0.428 |
8 |
3 |
0 |
0.000 |
7 |
|
[CTP]A:306 |
27 |
1 |
571 |
f |
A |
x,y,z |
1_555 |
36 |
10 |
14818 |
271.2 |
-0.3 |
0.715 |
13 |
0 |
0 |
0.167 |
8 |
|
A |
30 |
7 |
14818 |
x |
A |
z+1/2,x-1/2,y-1/2 |
17_544 |
27 |
7 |
14818 |
238.1 |
-0.6 |
0.524 |
4 |
2 |
0 |
0.000 |
9 |
|
[ATP]A:305 |
22 |
1 |
618 |
◊ |
A |
-x,y,-z-1 |
3_554 |
21 |
10 |
14818 |
204.6 |
3.4 |
0.837 |
6 |
0 |
0 |
0.000 |
10 |
|
A |
22 |
6 |
14818 |
x |
A |
-x-1/2,y-1/2,-z-1/2 |
15_444 |
25 |
9 |
14818 |
169.9 |
-0.7 |
0.492 |
2 |
2 |
0 |
0.000 |
11 |
|
[ATP]A:305 |
15 |
1 |
618 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
14818 |
117.2 |
-2.6 |
0.420 |
2 |
0 |
0 |
0.098 |
12 |
|
[EDO]A:309 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
14 |
10 |
14818 |
88.6 |
2.4 |
0.469 |
1 |
0 |
0 |
0.000 |
13 |
|
A |
13 |
5 |
14818 |
◊ |
A |
x,-y-1,-z-1 |
4_544 |
13 |
5 |
14818 |
84.0 |
1.3 |
0.803 |
0 |
0 |
0 |
0.000 |
14 |
|
[EDO]A:308 |
4 |
1 |
189 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
14818 |
68.1 |
0.9 |
0.213 |
3 |
0 |
0 |
0.000 |
15 |
|
A |
7 |
3 |
14818 |
◊ |
A |
-x,y,-z-1 |
3_554 |
7 |
3 |
14818 |
66.3 |
0.1 |
0.609 |
0 |
0 |
0 |
0.000 |
16 |
|
[ACE]A:1 |
3 |
1 |
173 |
◊ |
A |
-x,-y-1,z |
2_545 |
11 |
6 |
14818 |
63.2 |
-1.5 |
0.479 |
0 |
0 |
0 |
0.042 |
17 |
|
A |
15 |
3 |
14818 |
◊ |
[EDO]A:307 |
-z-1/2,x-1/2,-y-1/2 |
20_444 |
4 |
1 |
181 |
62.5 |
1.7 |
0.210 |
0 |
0 |
0 |
0.000 |
18 |
|
[CTP]A:306 |
6 |
1 |
571 |
x |
[CTP]A:306 |
z,-x,-y |
6_555 |
7 |
1 |
571 |
55.8 |
-1.4 |
0.439 |
0 |
0 |
0 |
0.024 |
19 |
|
[EDO]A:307 |
3 |
1 |
181 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
14818 |
54.9 |
2.1 |
0.335 |
2 |
0 |
0 |
0.000 |
20 |
|
A |
8 |
2 |
14818 |
f |
[EDO]A:309 |
z,x,y |
5_555 |
3 |
1 |
184 |
54.9 |
1.5 |
0.225 |
0 |
0 |
0 |
0.000 |
21 |
|
[EDO]A:310 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
14818 |
53.5 |
0.8 |
0.220 |
1 |
0 |
0 |
0.000 |
22 |
|
[CTP]A:306 |
6 |
1 |
571 |
◊ |
A |
-x,-y,z |
2_555 |
6 |
3 |
14818 |
49.5 |
-1.5 |
0.418 |
0 |
0 |
0 |
0.025 |
23 |
|
A |
9 |
2 |
14818 |
x |
A |
z,-x,-y |
6_555 |
7 |
1 |
14818 |
49.1 |
0.0 |
0.576 |
0 |
0 |
0 |
0.000 |
24 |
|
A |
8 |
4 |
14818 |
◊ |
[EDO]A:308 |
z+1/2,-x-1/2,-y-1/2 |
18_544 |
4 |
1 |
189 |
48.5 |
1.3 |
0.262 |
1 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:310 |
4 |
1 |
185 |
◊ |
A |
-z-1/2,-x-1/2,y-1/2 |
19_444 |
11 |
4 |
14818 |
47.8 |
1.4 |
0.817 |
1 |
0 |
0 |
0.000 |
26 |
|
[ATP]A:305 |
8 |
1 |
618 |
◊ |
A |
z+1/2,-x-1/2,-y-1/2 |
18_544 |
7 |
3 |
14818 |
43.0 |
0.5 |
0.667 |
0 |
0 |
0 |
0.000 |
27 |
|
[CTP]A:306 |
6 |
1 |
571 |
f |
[MG]A:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
42.3 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.191 |
28 |
|
[CTP]A:306 |
6 |
1 |
571 |
◊ |
A |
z,-x,-y |
6_555 |
2 |
1 |
14818 |
38.9 |
1.0 |
0.812 |
1 |
0 |
0 |
0.000 |
29 |
|
[ACE]A:1 |
3 |
1 |
173 |
cf |
A |
x,y,z |
1_555 |
5 |
2 |
14818 |
36.9 |
-0.2 |
0.821 |
0 |
0 |
0 |
0.005 |
30 |
|
[ATP]A:305 |
4 |
1 |
618 |
f |
[MG]A:303 |
x,y,z |
1_555 |
1 |
1 |
98 |
35.4 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.154 |
31 |
|
[ACE]A:1 |
3 |
1 |
173 |
◊ |
A |
z+1/2,x-1/2,y-1/2 |
17_544 |
5 |
3 |
14818 |
35.1 |
-0.8 |
0.370 |
0 |
0 |
0 |
0.000 |
32 |
|
[CL]A:301 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
14818 |
33.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.118 |
33 |
|
[EDO]A:307 |
2 |
1 |
181 |
f |
A |
z+1/2,-x-1/2,-y-1/2 |
18_544 |
5 |
2 |
14818 |
33.8 |
0.7 |
0.454 |
1 |
0 |
0 |
0.000 |
34 |
|
[EDO]A:308 |
2 |
1 |
189 |
◊ |
A |
-x,-y,z |
2_555 |
7 |
1 |
14818 |
31.8 |
0.8 |
0.365 |
0 |
0 |
0 |
0.000 |
35 |
|
[EDO]A:310 |
2 |
1 |
185 |
◊ |
A |
-x-1/2,y-1/2,-z-1/2 |
15_444 |
7 |
2 |
14818 |
30.9 |
0.8 |
0.816 |
1 |
0 |
0 |
0.000 |
36 |
|
[CTP]A:306 |
5 |
1 |
571 |
◊ |
A |
z,x,y |
5_555 |
2 |
1 |
14818 |
26.8 |
-0.6 |
0.535 |
0 |
0 |
0 |
0.012 |
37 |
|
[EDO]A:310 |
2 |
1 |
185 |
◊ |
A |
-z-1/2,x-1/2,-y-1/2 |
20_444 |
2 |
1 |
14818 |
24.8 |
0.4 |
0.246 |
0 |
0 |
0 |
0.000 |
38 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
14818 |
24.2 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.062 |
39 |
|
[CL]A:301 |
1 |
1 |
125 |
◊ |
A |
-z-1/2,x-1/2,-y-1/2 |
20_444 |
8 |
3 |
14818 |
23.4 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.000 |
40 |
|
[MG]A:303 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
14818 |
22.8 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.047 |
41 |
|
[CL]A:301 |
1 |
1 |
125 |
◊ |
A |
-x,-y-1,z |
2_545 |
2 |
1 |
14818 |
22.2 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.065 |
42 |
|
[MG]A:303 |
1 |
1 |
98 |
◊ |
A |
z+1/2,-x-1/2,-y-1/2 |
18_544 |
6 |
2 |
14818 |
20.2 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
43 |
|
[MG]A:304 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
7 |
3 |
14818 |
17.7 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.039 |
44 |
|
[CL]A:301 |
1 |
1 |
125 |
◊ |
[ACE]A:1 |
-x,-y-1,z |
2_545 |
2 |
1 |
173 |
17.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.055 |
45 |
|
[MG]A:303 |
1 |
1 |
98 |
◊ |
A |
-x,y,-z-1 |
3_554 |
1 |
1 |
14818 |
12.1 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
46 |
|
[CL]A:301 |
1 |
1 |
125 |
f |
[EDO]A:308 |
-z-1/2,x-1/2,-y-1/2 |
20_444 |
1 |
1 |
189 |
11.4 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.017 |
47 |
|
[CL]A:301 |
1 |
1 |
125 |
◊ |
A |
-z-1/2,-x-1/2,y-1/2 |
19_444 |
2 |
1 |
14818 |
11.2 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.000 |
48 |
|
[EDO]A:310 |
1 |
1 |
185 |
fx |
[MG]A:304 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.1 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.100 |
49 |
|
[MG]A:302 |
1 |
1 |
98 |
◊ |
A |
z,x,y |
5_555 |
2 |
1 |
14818 |
9.8 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.019 |
50 |
|
[MG]A:304 |
1 |
1 |
98 |
x |
A |
-x-1/2,y-1/2,-z-1/2 |
15_444 |
3 |
1 |
14818 |
9.0 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
51 |
|
[ACE]A:1 |
2 |
1 |
173 |
◊ |
[EDO]A:308 |
z+1/2,-x-1/2,-y-1/2 |
18_544 |
1 |
1 |
189 |
6.6 |
0.1 |
0.943 |
0 |
0 |
0 |
0.000 |
52 |
|
A |
1 |
1 |
14818 |
◊ |
[CTP]A:306 |
z,-x,-y |
6_555 |
2 |
1 |
571 |
1.0 |
0.0 |
0.614 |
0 |
0 |
0 |
0.000 |
|