## |
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 |
|
C |
555 |
130 |
15754 |
◊ |
C |
-x+2,y,-z+1 |
2_756 |
555 |
130 |
15754 |
5359.7 |
-60.8 |
0.197 |
96 |
20 |
0 |
0.837 |
2 |
|
D |
230 |
60 |
17997 |
◊ |
2 |
x,y,z |
1_555 |
236 |
59 |
15184 |
2190.7 |
-11.1 |
0.764 |
41 |
17 |
0 |
0.956 |
3 |
|
C |
152 |
34 |
15754 |
◊ |
1 |
-x+2,y,-z+1 |
2_756 |
158 |
47 |
15786 |
1509.6 |
-15.2 |
0.346 |
24 |
7 |
0 |
0.490 |
4 |
|
2 |
155 |
42 |
15184 |
◊ |
1 |
x,y,z |
1_555 |
170 |
45 |
15786 |
1482.7 |
-22.9 |
0.121 |
17 |
10 |
0 |
0.642 |
5 |
|
D |
104 |
28 |
17997 |
◊ |
C |
x,y,z |
1_555 |
108 |
30 |
15754 |
966.6 |
-5.7 |
0.642 |
21 |
6 |
0 |
0.471 |
6 |
|
D |
99 |
36 |
17997 |
◊ |
1 |
-x+2,y,-z+1 |
2_756 |
89 |
20 |
15786 |
898.5 |
-12.7 |
0.153 |
9 |
1 |
0 |
0.336 |
7 |
|
1 |
81 |
23 |
15786 |
◊ |
A |
x,y,z |
1_555 |
70 |
17 |
3243 |
659.2 |
-7.9 |
0.410 |
9 |
0 |
0 |
0.355 |
8 |
|
D |
64 |
22 |
17997 |
◊ |
1 |
x,y,z-1 |
1_554 |
61 |
16 |
15786 |
557.9 |
-9.3 |
0.185 |
5 |
1 |
0 |
0.154 |
9 |
|
D |
67 |
21 |
17997 |
◊ |
C |
-x+2,y,-z+1 |
2_756 |
47 |
11 |
15754 |
507.4 |
-5.5 |
0.399 |
7 |
3 |
0 |
0.081 |
10 |
|
C |
58 |
19 |
15754 |
◊ |
A |
-x+2,y,-z+1 |
2_756 |
41 |
8 |
3243 |
416.8 |
-4.6 |
0.488 |
2 |
0 |
0 |
0.075 |
11 |
|
2 |
39 |
11 |
15184 |
◊ |
A |
x,y,z |
1_555 |
29 |
7 |
3243 |
313.4 |
-3.3 |
0.443 |
3 |
2 |
0 |
0.045 |
12 |
|
1 |
29 |
9 |
15786 |
◊ |
1 |
-x+2,y,-z+1 |
2_756 |
29 |
9 |
15786 |
284.7 |
-6.5 |
0.123 |
0 |
0 |
0 |
0.030 |
13 |
|
2 |
39 |
15 |
15184 |
◊ |
1 |
-x+5/2,y-1/2,-z+1 |
4_746 |
26 |
9 |
15786 |
262.4 |
0.4 |
0.809 |
5 |
2 |
0 |
0.000 |
14 |
|
[FMN]C:501 |
29 |
1 |
620 |
f |
C |
-x+2,y,-z+1 |
2_756 |
42 |
13 |
15754 |
260.4 |
-0.4 |
0.771 |
12 |
0 |
0 |
0.169 |
15 |
|
[FMN]C:501 |
22 |
1 |
620 |
◊ |
C |
x,y,z |
1_555 |
38 |
11 |
15754 |
209.7 |
-3.3 |
0.544 |
3 |
0 |
0 |
0.073 |
16 |
|
C |
29 |
12 |
15754 |
◊ |
A |
x,y,z |
1_555 |
26 |
7 |
3243 |
200.8 |
-0.7 |
0.677 |
4 |
0 |
0 |
0.022 |
17 |
|
D |
19 |
7 |
17997 |
◊ |
A |
x,y,z |
1_555 |
24 |
6 |
3243 |
169.2 |
-1.6 |
0.290 |
0 |
0 |
0 |
0.014 |
18 |
|
2 |
19 |
5 |
15184 |
◊ |
D |
-x+5/2,y-1/2,-z+1 |
4_746 |
23 |
8 |
17997 |
159.8 |
1.4 |
0.873 |
2 |
0 |
0 |
0.000 |
19 |
|
2 |
17 |
5 |
15184 |
x |
2 |
-x+5/2,y-1/2,-z+1 |
4_746 |
20 |
5 |
15184 |
153.2 |
0.7 |
0.717 |
4 |
0 |
0 |
0.000 |
20 |
|
2 |
10 |
4 |
15184 |
◊ |
A |
-x+5/2,y-1/2,-z+1 |
4_746 |
12 |
4 |
3243 |
134.6 |
-1.8 |
0.401 |
0 |
0 |
0 |
0.000 |
21 |
|
2 |
11 |
4 |
15184 |
◊ |
D |
-x+5/2,y-1/2,-z |
4_745 |
14 |
5 |
17997 |
119.6 |
-1.1 |
0.471 |
0 |
0 |
0 |
0.000 |
22 |
|
[EDO]D:403 |
4 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
19 |
7 |
17997 |
116.9 |
4.3 |
0.773 |
2 |
0 |
0 |
0.000 |
23 |
|
[GOL]D:405 |
6 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
16 |
9 |
17997 |
116.0 |
-0.4 |
0.556 |
4 |
0 |
0 |
0.064 |
24 |
|
2 |
11 |
5 |
15184 |
◊ |
1 |
-x+2,y,-z+1 |
2_756 |
10 |
5 |
15786 |
112.8 |
-2.3 |
0.227 |
0 |
0 |
0 |
0.021 |
25 |
|
C |
17 |
5 |
15754 |
◊ |
1 |
x,y,z |
1_555 |
11 |
4 |
15786 |
104.2 |
0.5 |
0.795 |
1 |
2 |
0 |
0.001 |
26 |
|
[FMN]C:501 |
17 |
1 |
620 |
◊ |
A |
x,y,z |
1_555 |
16 |
4 |
3243 |
96.1 |
-0.3 |
0.726 |
3 |
0 |
0 |
0.022 |
27 |
|
[EDO]D:404 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
17 |
7 |
17997 |
92.0 |
2.0 |
0.269 |
3 |
0 |
0 |
0.000 |
28 |
|
[EDO]2:402 |
4 |
1 |
184 |
f |
2 |
x,y,z |
1_555 |
12 |
6 |
15184 |
89.5 |
2.5 |
0.303 |
3 |
0 |
0 |
0.000 |
29 |
|
D |
9 |
3 |
17997 |
x |
D |
-x+5/2,y-1/2,-z |
4_745 |
15 |
5 |
17997 |
89.4 |
-1.5 |
0.282 |
0 |
0 |
0 |
0.000 |
30 |
|
[SO4]1:302 |
5 |
1 |
186 |
f |
1 |
x,y,z |
1_555 |
14 |
4 |
15786 |
88.9 |
-13.3 |
0.811 |
4 |
0 |
0 |
0.449 |
31 |
|
2 |
10 |
5 |
15184 |
◊ |
C |
x,y-1,z |
1_545 |
12 |
3 |
15754 |
84.6 |
-1.3 |
0.436 |
1 |
0 |
0 |
0.000 |
32 |
|
[EDO]2:404 |
4 |
1 |
184 |
f |
1 |
x,y,z |
1_555 |
9 |
7 |
15786 |
83.0 |
2.8 |
0.337 |
5 |
0 |
0 |
0.000 |
33 |
|
[EDO]2:403 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
13 |
3 |
17997 |
78.9 |
2.3 |
0.442 |
0 |
0 |
0 |
0.000 |
34 |
|
1 |
7 |
3 |
15786 |
◊ |
D |
-x+5/2,y-1/2,-z+1 |
4_746 |
12 |
7 |
17997 |
72.3 |
1.6 |
0.851 |
2 |
2 |
0 |
0.000 |
35 |
|
[EDO]D:401 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
15 |
7 |
17997 |
72.3 |
1.4 |
0.282 |
6 |
0 |
0 |
0.037 |
36 |
|
[EDO]2:404 |
4 |
1 |
184 |
◊ |
2 |
x,y,z |
1_555 |
12 |
6 |
15184 |
71.8 |
2.0 |
0.302 |
1 |
0 |
0 |
0.000 |
37 |
|
[EDO]2:403 |
4 |
1 |
184 |
f |
2 |
x,y,z |
1_555 |
10 |
5 |
15184 |
70.0 |
1.9 |
0.879 |
2 |
0 |
0 |
0.000 |
38 |
|
[CL]D:402 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
17997 |
68.2 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.284 |
39 |
|
[EDO]D:401 |
4 |
1 |
183 |
◊ |
2 |
x,y,z |
1_555 |
12 |
4 |
15184 |
67.1 |
2.0 |
0.297 |
1 |
0 |
0 |
0.000 |
40 |
|
2 |
5 |
4 |
15184 |
◊ |
C |
-x+2,y-1,-z+1 |
2_746 |
8 |
3 |
15754 |
64.5 |
-1.7 |
0.204 |
0 |
0 |
0 |
0.000 |
41 |
|
[CL]1:303 |
1 |
1 |
125 |
f |
1 |
x,y,z |
1_555 |
10 |
4 |
15786 |
60.7 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.214 |
42 |
|
[EDO]2:402 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
11 |
3 |
17997 |
56.9 |
1.3 |
0.672 |
0 |
0 |
0 |
0.000 |
43 |
|
2 |
5 |
2 |
15184 |
◊ |
D |
x,y-1,z |
1_545 |
6 |
3 |
17997 |
38.5 |
-0.1 |
0.548 |
0 |
0 |
0 |
0.000 |
44 |
|
1 |
3 |
2 |
15786 |
◊ |
1 |
-x+2,y,-z+2 |
2_757 |
3 |
2 |
15786 |
27.4 |
-0.3 |
0.498 |
0 |
0 |
0 |
0.002 |
45 |
|
[CL]1:303 |
1 |
1 |
125 |
◊ |
1 |
-x+2,y,-z+2 |
2_757 |
3 |
1 |
15786 |
22.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.027 |
46 |
|
[EDO]D:401 |
2 |
1 |
183 |
◊ |
1 |
-x+2,y,-z+1 |
2_756 |
2 |
1 |
15786 |
21.7 |
0.9 |
0.973 |
1 |
0 |
0 |
0.000 |
47 |
|
[SO4]1:302 |
2 |
1 |
186 |
◊ |
C |
-x+2,y,-z+1 |
2_756 |
1 |
1 |
15754 |
6.0 |
-0.6 |
0.879 |
0 |
0 |
0 |
0.011 |
48 |
|
[EDO]D:403 |
1 |
1 |
186 |
f |
2 |
x,y,z |
1_555 |
1 |
1 |
15184 |
2.5 |
0.0 |
0.643 |
0 |
0 |
0 |
0.000 |
|