## |
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 |
106 |
29 |
16120 |
◊ |
A |
y+1/3,x-1/3,-z-1/3 |
16_544 |
103 |
29 |
16120 |
1069.5 |
-12.8 |
0.029 |
14 |
24 |
0 |
0.238 |
2 |
2 |
|
B |
108 |
29 |
13298 |
x |
B |
-y-1,x-y-1,z |
2_445 |
109 |
32 |
13298 |
1007.1 |
-6.3 |
0.318 |
17 |
8 |
0 |
0.404 |
3 |
3 |
|
B |
92 |
24 |
13298 |
◊ |
A |
x,y,z |
1_555 |
83 |
25 |
16120 |
843.3 |
-8.3 |
0.132 |
12 |
8 |
0 |
0.000 |
4 |
4 |
|
B |
74 |
19 |
13298 |
◊ |
A |
y+1/3,x-1/3,-z-1/3 |
16_544 |
80 |
21 |
16120 |
754.0 |
0.6 |
0.632 |
10 |
1 |
0 |
0.000 |
5 |
5 |
|
A |
42 |
12 |
16120 |
◊ |
A |
-x-2/3,-x+y-1/3,-z-1/3 |
17_444 |
41 |
12 |
16120 |
353.2 |
-5.7 |
0.093 |
2 |
0 |
0 |
0.000 |
6 |
6 |
|
B |
33 |
9 |
13298 |
◊ |
B |
-x,-x+y,-z |
5_555 |
33 |
9 |
13298 |
311.6 |
4.4 |
0.910 |
8 |
12 |
0 |
0.000 |
7 |
7 |
|
[PAL]B:292 |
16 |
1 |
375 |
f |
B |
x,y,z |
1_555 |
37 |
16 |
13298 |
236.7 |
-4.8 |
0.555 |
16 |
0 |
0 |
0.321 |
8 |
8 |
|
[DOR]A:425 |
11 |
1 |
287 |
f |
A |
x,y,z |
1_555 |
28 |
14 |
16120 |
191.9 |
1.9 |
0.285 |
6 |
0 |
0 |
0.016 |
9 |
9 |
|
A |
16 |
3 |
16120 |
◊ |
B |
-y-1,x-y-1,z |
2_445 |
12 |
5 |
13298 |
131.2 |
-0.2 |
0.499 |
2 |
2 |
0 |
0.000 |
10 |
10 |
|
[EDO]B:306 |
4 |
1 |
181 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
13298 |
108.4 |
2.6 |
0.431 |
2 |
0 |
0 |
0.000 |
11 |
11 |
|
[EDO]B:304 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
13298 |
104.0 |
2.4 |
0.434 |
3 |
0 |
0 |
0.000 |
12 |
12 |
|
[BA]B:297 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
13298 |
103.8 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.175 |
13 |
13 |
|
[EDO]B:312 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
14 |
8 |
13298 |
100.5 |
3.2 |
0.455 |
2 |
0 |
0 |
0.000 |
14 |
14 |
|
[EDO]B:311 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
15 |
8 |
13298 |
99.8 |
3.9 |
0.524 |
2 |
0 |
0 |
0.000 |
15 |
15 |
|
[PO4]B:293 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
13298 |
97.8 |
-6.7 |
0.630 |
3 |
0 |
0 |
0.217 |
16 |
16 |
|
[EDO]B:302 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
16 |
9 |
13298 |
94.0 |
3.5 |
0.535 |
4 |
0 |
0 |
0.000 |
17 |
17 |
|
[EDO]B:301 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
16120 |
92.3 |
2.1 |
0.237 |
3 |
0 |
0 |
0.000 |
18 |
18 |
|
[BA]B:295 |
1 |
1 |
216 |
fx |
[BA]B:295 |
-y-1,x-y-1,z |
2_445 |
1 |
1 |
216 |
91.1 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.103 |
19 |
19 |
|
[EDO]B:308 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
13298 |
89.5 |
3.2 |
0.320 |
4 |
0 |
0 |
0.000 |
20 |
20 |
|
[EDO]B:307 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
16120 |
86.8 |
2.2 |
0.250 |
2 |
0 |
0 |
0.000 |
21 |
21 |
|
[EDO]B:310 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
15 |
4 |
16120 |
79.1 |
2.0 |
0.235 |
1 |
0 |
0 |
0.000 |
22 |
22 |
|
[BA]B:296 |
1 |
1 |
216 |
fx |
[BA]B:296 |
-y-1,x-y-1,z |
2_445 |
1 |
1 |
216 |
75.2 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.085 |
23 |
23 |
|
[EDO]B:309 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
13298 |
69.3 |
2.5 |
0.294 |
1 |
0 |
0 |
0.000 |
24 |
24 |
|
[EDO]B:310 |
4 |
1 |
185 |
f |
A |
y+1/3,x-1/3,-z-1/3 |
16_544 |
7 |
3 |
16120 |
67.8 |
1.8 |
0.907 |
2 |
0 |
0 |
0.000 |
25 |
25 |
|
[EDO]B:305 |
3 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
13298 |
65.0 |
1.6 |
0.255 |
1 |
0 |
0 |
0.000 |
26 |
26 |
|
B |
6 |
3 |
13298 |
◊ |
[PAL]B:292 |
-y-1,x-y-1,z |
2_445 |
9 |
1 |
375 |
64.9 |
-1.1 |
0.746 |
5 |
0 |
0 |
0.088 |
27 |
27 |
|
[EDO]B:303 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
13298 |
64.7 |
1.6 |
0.453 |
3 |
0 |
0 |
0.000 |
28 |
28 |
|
[BA]B:296 |
1 |
1 |
216 |
fx |
[BA]B:295 |
x,y,z |
1_555 |
1 |
1 |
216 |
54.9 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.187 |
29 |
29 |
|
B |
13 |
4 |
13298 |
f |
[EDO]B:302 |
-y-1,x-y-1,z |
2_445 |
4 |
1 |
185 |
50.6 |
1.5 |
0.780 |
1 |
0 |
0 |
0.000 |
30 |
30 |
|
[BA]B:296 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
7 |
3 |
13298 |
49.4 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.175 |
31 |
|
[BA]B:295 |
1 |
1 |
216 |
x |
B |
x,y,z |
1_555 |
7 |
3 |
13298 |
48.8 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.175 |
Average: |
49.1 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.175 |
31 |
32 |
|
[EDO]B:306 |
3 |
1 |
181 |
f |
[BA]B:297 |
x,y,z |
1_555 |
1 |
1 |
216 |
47.5 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.024 |
32 |
33 |
|
[EDO]B:305 |
3 |
1 |
183 |
◊ |
B |
-x,-x+y,-z |
5_555 |
8 |
2 |
13298 |
41.2 |
0.9 |
0.803 |
0 |
0 |
0 |
0.000 |
33 |
34 |
|
[ZN]A:423 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
16120 |
40.9 |
-31.2 |
0.000 |
0 |
0 |
0 |
0.659 |
34 |
35 |
|
[EDO]B:312 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
16120 |
39.5 |
0.6 |
0.432 |
0 |
0 |
0 |
0.000 |
35 |
36 |
|
[EDO]B:303 |
4 |
1 |
183 |
◊ |
B |
-y-1,x-y-1,z |
2_445 |
5 |
4 |
13298 |
33.1 |
1.3 |
0.900 |
0 |
0 |
0 |
0.000 |
36 |
37 |
|
[EDO]B:303 |
4 |
1 |
183 |
fx |
[BA]B:296 |
x,y,z |
1_555 |
1 |
1 |
216 |
32.5 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.041 |
37 |
38 |
|
[EDO]B:311 |
2 |
1 |
183 |
f |
A |
y+1/3,x-1/3,-z-1/3 |
16_544 |
8 |
3 |
16120 |
31.3 |
0.4 |
0.696 |
1 |
0 |
0 |
0.002 |
38 |
39 |
|
[EDO]B:309 |
3 |
1 |
184 |
f |
[PO4]B:293 |
x,y,z |
1_555 |
3 |
1 |
188 |
29.2 |
-1.0 |
0.947 |
0 |
0 |
0 |
0.028 |
39 |
40 |
|
[EDO]B:305 |
3 |
1 |
183 |
f |
[PO4]B:293 |
x,y,z |
1_555 |
3 |
1 |
188 |
25.0 |
-0.9 |
0.996 |
1 |
0 |
0 |
0.037 |
40 |
41 |
|
[EDO]B:307 |
2 |
1 |
182 |
◊ |
[EDO]B:301 |
x,y,z |
1_555 |
3 |
1 |
183 |
21.4 |
1.0 |
1.000 |
0 |
0 |
0 |
0.000 |
41 |
42 |
|
[EDO]B:303 |
4 |
1 |
183 |
fx |
[EDO]B:303 |
-y-1,x-y-1,z |
2_445 |
2 |
1 |
183 |
19.5 |
1.1 |
1.000 |
0 |
0 |
0 |
0.000 |
42 |
43 |
|
[DOR]A:425 |
5 |
1 |
287 |
f |
[ZN]A:423 |
x,y,z |
1_555 |
1 |
1 |
98 |
19.4 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.152 |
43 |
44 |
|
B |
3 |
1 |
13298 |
◊ |
[EDO]B:303 |
-y-1,x-y-1,z |
2_445 |
2 |
1 |
183 |
17.0 |
0.4 |
0.887 |
1 |
0 |
0 |
0.000 |
44 |
45 |
|
[EDO]B:309 |
1 |
1 |
184 |
f |
[EDO]B:305 |
x,y,z |
1_555 |
2 |
1 |
183 |
13.4 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
45 |
46 |
|
[EDO]B:301 |
2 |
1 |
183 |
f |
B |
y+1/3,x-1/3,-z-1/3 |
16_544 |
3 |
3 |
13298 |
9.0 |
0.4 |
0.854 |
0 |
0 |
0 |
0.000 |
46 |
47 |
|
[EDO]B:303 |
1 |
1 |
183 |
fx |
[BA]B:295 |
x,y,z |
1_555 |
1 |
1 |
216 |
9.0 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.015 |
47 |
48 |
|
[EDO]B:307 |
2 |
1 |
182 |
f |
A |
-x-2/3,-x+y-1/3,-z-1/3 |
17_444 |
3 |
1 |
16120 |
5.5 |
0.0 |
0.697 |
0 |
0 |
0 |
0.000 |
|