| ## |
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 |
|
H |
176 |
49 |
11584 |
◊ |
L |
x,y,z |
1_555 |
195 |
54 |
11676 |
1685.8 |
-27.8 |
0.019 |
9 |
2 |
0 |
0.160 |
2 |
|
H |
53 |
17 |
11584 |
◊ |
H |
x-y,-y,-z+2/3 |
5_555 |
53 |
17 |
11584 |
505.0 |
-5.4 |
0.355 |
5 |
0 |
0 |
0.034 |
3 |
|
L |
55 |
16 |
11676 |
◊ |
H |
-y,x-y+1,z+1/3 |
2_565 |
48 |
15 |
11584 |
495.9 |
-4.5 |
0.375 |
9 |
0 |
0 |
0.051 |
4 |
|
H |
22 |
8 |
11584 |
◊ |
H |
-x,-x+y,-z+1/3 |
6_555 |
22 |
8 |
11584 |
212.2 |
-3.4 |
0.273 |
2 |
0 |
0 |
0.000 |
5 |
|
H |
20 |
14 |
11584 |
◊ |
L |
y-1,x,-z |
4_455 |
19 |
7 |
11676 |
180.9 |
0.9 |
0.707 |
3 |
0 |
0 |
0.000 |
6 |
|
H |
14 |
4 |
11584 |
◊ |
L |
x-y,-y,-z+2/3 |
5_555 |
18 |
6 |
11676 |
149.5 |
-0.2 |
0.634 |
2 |
1 |
0 |
0.006 |
7 |
|
[SO4]H:245 |
5 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
22 |
7 |
11584 |
122.3 |
-16.4 |
0.786 |
2 |
0 |
0 |
0.154 |
8 |
|
[FLC]H:240 |
10 |
1 |
314 |
f |
H |
x,y,z |
1_555 |
17 |
7 |
11584 |
122.1 |
0.6 |
0.553 |
2 |
0 |
0 |
0.002 |
9 |
|
[FLC]H:241 |
9 |
1 |
319 |
◊ |
H |
x,y,z |
1_555 |
17 |
5 |
11584 |
109.0 |
0.5 |
0.603 |
3 |
0 |
0 |
0.004 |
10 |
|
[TRS]L:216 |
7 |
1 |
249 |
f |
L |
x,y,z |
1_555 |
17 |
7 |
11676 |
99.1 |
3.1 |
0.931 |
4 |
0 |
0 |
0.000 |
11 |
|
[TRS]H:236 |
7 |
1 |
254 |
f |
H |
x,y,z |
1_555 |
13 |
4 |
11584 |
98.3 |
1.6 |
0.797 |
4 |
0 |
0 |
0.001 |
12 |
|
[TRS]H:239 |
6 |
1 |
252 |
f |
H |
x,y,z |
1_555 |
13 |
4 |
11584 |
93.0 |
1.9 |
0.820 |
4 |
0 |
0 |
0.000 |
13 |
|
[TRS]H:237 |
7 |
1 |
251 |
f |
H |
x,y,z |
1_555 |
15 |
5 |
11584 |
90.8 |
1.2 |
0.795 |
1 |
0 |
0 |
0.000 |
14 |
|
[SO4]H:244 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
14 |
7 |
11584 |
90.2 |
-10.7 |
0.956 |
3 |
0 |
0 |
0.107 |
15 |
|
[TRS]L:217 |
6 |
1 |
252 |
◊ |
H |
-y,x-y+1,z+1/3 |
2_565 |
11 |
5 |
11584 |
88.5 |
1.5 |
0.807 |
1 |
0 |
0 |
0.000 |
16 |
|
[SO4]L:228 |
5 |
1 |
185 |
f |
L |
x,y,z |
1_555 |
12 |
5 |
11676 |
85.9 |
-12.4 |
0.812 |
5 |
0 |
0 |
0.089 |
17 |
|
[FLC]L:221 |
9 |
1 |
317 |
◊ |
L |
x,y,z |
1_555 |
10 |
3 |
11676 |
85.5 |
0.2 |
0.411 |
1 |
0 |
0 |
0.001 |
18 |
|
[SO4]H:243 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
11 |
5 |
11584 |
85.3 |
-10.6 |
0.876 |
6 |
0 |
0 |
0.118 |
19 |
|
[TRS]L:215 |
6 |
1 |
256 |
◊ |
L |
x,y,z |
1_555 |
10 |
4 |
11676 |
83.0 |
1.7 |
0.723 |
2 |
0 |
0 |
0.000 |
20 |
|
L |
11 |
6 |
11676 |
x |
L |
-y,x-y+1,z+1/3 |
2_565 |
8 |
3 |
11676 |
81.6 |
-0.6 |
0.493 |
0 |
0 |
0 |
0.000 |
21 |
|
[TRS]H:238 |
6 |
1 |
253 |
◊ |
H |
x,y,z |
1_555 |
14 |
6 |
11584 |
80.6 |
1.0 |
0.722 |
1 |
0 |
0 |
0.000 |
22 |
|
[TRS]L:219 |
7 |
1 |
256 |
f |
L |
x,y,z |
1_555 |
11 |
5 |
11676 |
79.9 |
0.4 |
0.591 |
1 |
0 |
0 |
0.000 |
23 |
|
[FLC]L:221 |
8 |
1 |
317 |
f |
H |
x,y,z |
1_555 |
11 |
4 |
11584 |
79.7 |
0.3 |
0.526 |
4 |
0 |
0 |
0.013 |
24 |
|
H |
13 |
4 |
11584 |
◊ |
[TRS]L:220 |
y-1,x,-z |
4_455 |
5 |
1 |
256 |
79.6 |
2.3 |
0.203 |
1 |
0 |
0 |
0.000 |
25 |
|
L |
5 |
2 |
11676 |
x |
L |
-y,x-y+1,z-2/3 |
2_564 |
7 |
3 |
11676 |
78.9 |
0.9 |
0.811 |
1 |
0 |
0 |
0.000 |
26 |
|
[SO4]L:226 |
5 |
1 |
186 |
f |
L |
x,y,z |
1_555 |
11 |
5 |
11676 |
75.9 |
-9.6 |
0.887 |
3 |
0 |
0 |
0.066 |
27 |
|
[SO4]H:247 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
11 |
4 |
11584 |
72.3 |
-9.7 |
0.813 |
3 |
0 |
0 |
0.098 |
28 |
|
[SO4]L:225 |
4 |
1 |
185 |
f |
L |
x,y,z |
1_555 |
10 |
4 |
11676 |
72.1 |
-10.7 |
0.807 |
4 |
0 |
0 |
0.075 |
29 |
|
[SO4]L:224 |
5 |
1 |
185 |
f |
L |
x,y,z |
1_555 |
10 |
4 |
11676 |
68.3 |
-10.1 |
0.636 |
3 |
0 |
0 |
0.069 |
30 |
|
[SO4]L:227 |
4 |
1 |
185 |
◊ |
L |
x,y,z |
1_555 |
9 |
4 |
11676 |
66.9 |
-7.8 |
0.911 |
2 |
0 |
0 |
0.043 |
31 |
|
[SO4]L:227 |
4 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
9 |
4 |
11584 |
66.7 |
-9.1 |
0.610 |
2 |
0 |
0 |
0.089 |
32 |
|
[SO4]L:223 |
4 |
1 |
184 |
f |
L |
x,y,z |
1_555 |
8 |
3 |
11676 |
66.1 |
-8.3 |
0.891 |
4 |
0 |
0 |
0.061 |
33 |
|
[TRS]L:218 |
5 |
1 |
257 |
f |
L |
x,y,z |
1_555 |
8 |
4 |
11676 |
65.6 |
0.7 |
0.602 |
0 |
0 |
0 |
0.000 |
34 |
|
L |
8 |
4 |
11676 |
◊ |
[SO4]L:226 |
-y,x-y+1,z-2/3 |
2_564 |
4 |
1 |
186 |
64.7 |
-7.5 |
0.920 |
2 |
0 |
0 |
0.000 |
35 |
|
H |
8 |
3 |
11584 |
f |
[SO4]L:222 |
y-1,x,-z |
4_455 |
5 |
1 |
183 |
61.1 |
-8.8 |
0.724 |
2 |
0 |
0 |
0.086 |
36 |
|
[SO4]L:222 |
4 |
1 |
183 |
◊ |
L |
x,y,z |
1_555 |
9 |
4 |
11676 |
60.0 |
-6.9 |
0.889 |
3 |
0 |
0 |
0.005 |
37 |
|
L |
10 |
6 |
11676 |
◊ |
[SO4]H:243 |
-y,x-y+1,z+1/3 |
2_565 |
4 |
1 |
185 |
57.9 |
-7.8 |
0.812 |
1 |
0 |
0 |
0.050 |
38 |
|
[SO4]H:242 |
4 |
1 |
186 |
◊ |
H |
x,y,z |
1_555 |
12 |
6 |
11584 |
57.2 |
-7.1 |
0.774 |
3 |
0 |
0 |
0.075 |
39 |
|
[SO4]H:242 |
5 |
1 |
186 |
◊ |
H |
x-y,-y,-z+2/3 |
5_555 |
10 |
5 |
11584 |
55.9 |
-7.5 |
0.786 |
2 |
0 |
0 |
0.075 |
40 |
|
[SO4]H:242 |
5 |
1 |
186 |
f |
[SO4]H:242 |
x-y,-y,-z+2/3 |
5_555 |
5 |
1 |
186 |
55.4 |
-11.4 |
0.993 |
0 |
0 |
0 |
0.094 |
41 |
|
[SO4]H:246 |
4 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
7 |
4 |
11584 |
55.1 |
-7.2 |
0.758 |
2 |
0 |
0 |
0.072 |
42 |
|
L |
7 |
2 |
11676 |
◊ |
[TRS]L:216 |
-y,x-y+1,z-2/3 |
2_564 |
5 |
1 |
249 |
54.8 |
1.2 |
0.751 |
0 |
0 |
0 |
0.000 |
43 |
|
[SO4]H:246 |
5 |
1 |
186 |
◊ |
L |
x,y,z |
1_555 |
4 |
3 |
11676 |
47.5 |
-5.4 |
0.910 |
2 |
0 |
0 |
0.031 |
44 |
|
[TRS]L:217 |
5 |
1 |
252 |
f |
L |
x,y,z |
1_555 |
4 |
2 |
11676 |
44.8 |
0.7 |
0.776 |
1 |
0 |
0 |
0.000 |
45 |
|
L |
4 |
2 |
11676 |
◊ |
[SO4]H:246 |
-y,x-y+1,z+1/3 |
2_565 |
4 |
1 |
186 |
43.9 |
-6.0 |
0.495 |
0 |
0 |
0 |
0.036 |
46 |
|
[SO4]L:225 |
4 |
1 |
185 |
◊ |
H |
x,y,z |
1_555 |
8 |
4 |
11584 |
40.1 |
-5.2 |
0.676 |
0 |
0 |
0 |
0.026 |
47 |
|
[TRS]L:220 |
3 |
1 |
256 |
f |
L |
x,y,z |
1_555 |
4 |
2 |
11676 |
37.4 |
1.0 |
0.931 |
2 |
0 |
0 |
0.000 |
48 |
|
[FLC]H:241 |
4 |
1 |
319 |
◊ |
[SO4]L:222 |
y-1,x,-z |
4_455 |
3 |
1 |
183 |
36.4 |
-3.9 |
0.708 |
0 |
0 |
0 |
0.019 |
49 |
|
[SO4]L:224 |
4 |
1 |
185 |
◊ |
L |
-y,x-y+1,z+1/3 |
2_565 |
3 |
2 |
11676 |
35.0 |
-4.3 |
0.872 |
1 |
0 |
0 |
0.000 |
50 |
|
[SO4]L:227 |
3 |
1 |
185 |
f |
[FLC]L:221 |
x,y,z |
1_555 |
4 |
1 |
317 |
34.1 |
-3.8 |
0.722 |
0 |
0 |
0 |
0.034 |
51 |
|
[TRS]L:218 |
2 |
1 |
257 |
f |
[TRS]L:216 |
x,y,z |
1_555 |
2 |
1 |
249 |
13.6 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
52 |
|
H |
2 |
1 |
11584 |
x |
H |
y-1,x,-z |
4_455 |
1 |
1 |
11584 |
13.5 |
0.7 |
0.869 |
0 |
0 |
0 |
0.000 |
53 |
|
[FLC]H:241 |
2 |
1 |
319 |
◊ |
L |
x-y,-y,-z+2/3 |
5_555 |
2 |
2 |
11676 |
11.5 |
0.2 |
0.655 |
0 |
0 |
0 |
0.000 |
54 |
|
L |
2 |
2 |
11676 |
f |
[TRS]L:215 |
-y,x-y+1,z-2/3 |
2_564 |
2 |
1 |
256 |
9.7 |
0.0 |
0.605 |
0 |
0 |
0 |
0.000 |
55 |
|
[SO4]L:226 |
2 |
1 |
186 |
f |
[TRS]L:216 |
x,y,z |
1_555 |
2 |
1 |
249 |
8.0 |
-0.9 |
0.980 |
0 |
0 |
0 |
0.005 |
56 |
|
[FLC]H:241 |
4 |
1 |
319 |
f |
L |
x,y,z |
1_555 |
2 |
1 |
11676 |
7.2 |
-0.1 |
0.388 |
0 |
0 |
0 |
0.000 |
57 |
|
[SO4]H:242 |
1 |
1 |
186 |
f |
[TRS]H:238 |
x,y,z |
1_555 |
1 |
1 |
253 |
3.7 |
-0.3 |
0.894 |
0 |
0 |
0 |
0.005 |
58 |
|
[FLC]H:241 |
1 |
1 |
319 |
◊ |
L |
y-1,x,-z |
4_455 |
1 |
1 |
11676 |
2.8 |
-0.0 |
0.422 |
0 |
0 |
0 |
0.000 |
59 |
|
[SO4]H:242 |
1 |
1 |
186 |
f |
[TRS]H:238 |
x-y,-y,-z+2/3 |
5_555 |
1 |
1 |
253 |
0.5 |
-0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
|