## |
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 |
543 |
128 |
15921 |
◊ |
C |
-x+2,y,-z+1 |
2_756 |
545 |
128 |
15921 |
5328.7 |
-59.7 |
0.201 |
86 |
18 |
0 |
0.857 |
2 |
|
D |
227 |
57 |
17943 |
◊ |
2 |
x,y,z |
1_555 |
232 |
56 |
15368 |
2193.3 |
-11.0 |
0.742 |
42 |
17 |
0 |
0.880 |
3 |
|
C |
150 |
35 |
15921 |
◊ |
1 |
-x+2,y,-z+1 |
2_756 |
161 |
49 |
15582 |
1531.6 |
-13.2 |
0.393 |
23 |
8 |
0 |
0.470 |
4 |
|
2 |
157 |
43 |
15368 |
◊ |
1 |
x,y,z |
1_555 |
176 |
46 |
15582 |
1515.6 |
-22.9 |
0.092 |
16 |
9 |
0 |
0.603 |
5 |
|
D |
101 |
28 |
17943 |
◊ |
C |
x,y,z |
1_555 |
108 |
30 |
15921 |
970.0 |
-6.4 |
0.588 |
22 |
6 |
0 |
0.513 |
6 |
|
D |
91 |
33 |
17943 |
◊ |
1 |
-x+2,y,-z+1 |
2_756 |
85 |
19 |
15582 |
829.3 |
-13.4 |
0.115 |
9 |
1 |
0 |
0.346 |
7 |
|
1 |
81 |
24 |
15582 |
◊ |
A |
x,y,z |
1_555 |
68 |
15 |
2413 |
676.3 |
-10.1 |
0.414 |
9 |
0 |
0 |
0.384 |
8 |
|
D |
63 |
22 |
17943 |
◊ |
1 |
x,y,z-1 |
1_554 |
61 |
17 |
15582 |
547.7 |
-8.7 |
0.221 |
6 |
1 |
0 |
0.147 |
9 |
|
D |
70 |
23 |
17943 |
◊ |
C |
-x+2,y,-z+1 |
2_756 |
48 |
11 |
15921 |
504.2 |
-6.4 |
0.327 |
8 |
3 |
0 |
0.081 |
10 |
|
2 |
38 |
12 |
15368 |
◊ |
A |
x,y,z |
1_555 |
28 |
6 |
2413 |
310.1 |
-2.7 |
0.507 |
3 |
2 |
0 |
0.043 |
11 |
|
2 |
40 |
15 |
15368 |
◊ |
1 |
-x+5/2,y-1/2,-z+1 |
4_746 |
26 |
9 |
15582 |
283.7 |
0.3 |
0.783 |
5 |
2 |
0 |
0.027 |
12 |
|
[FMN]C:401 |
29 |
1 |
618 |
f |
C |
-x+2,y,-z+1 |
2_756 |
41 |
13 |
15921 |
277.5 |
-0.6 |
0.781 |
12 |
0 |
0 |
0.178 |
13 |
|
1 |
24 |
8 |
15582 |
◊ |
1 |
-x+2,y,-z+1 |
2_756 |
24 |
8 |
15582 |
276.3 |
-5.9 |
0.099 |
0 |
0 |
0 |
0.027 |
14 |
|
[FMN]C:401 |
22 |
1 |
618 |
◊ |
C |
x,y,z |
1_555 |
38 |
12 |
15921 |
229.4 |
-3.8 |
0.534 |
3 |
0 |
0 |
0.088 |
15 |
|
2 |
18 |
5 |
15368 |
◊ |
D |
-x+5/2,y-1/2,-z+1 |
4_746 |
23 |
7 |
17943 |
184.9 |
1.2 |
0.831 |
2 |
4 |
0 |
0.002 |
16 |
|
2 |
18 |
5 |
15368 |
◊ |
A |
-x+5/2,y-1/2,-z+1 |
4_746 |
18 |
6 |
2413 |
169.5 |
-1.9 |
0.548 |
0 |
0 |
0 |
0.023 |
17 |
|
C |
23 |
7 |
15921 |
◊ |
A |
-x+2,y,-z+1 |
2_756 |
20 |
3 |
2413 |
159.6 |
-0.9 |
0.586 |
0 |
0 |
0 |
0.009 |
18 |
|
2 |
15 |
5 |
15368 |
x |
2 |
-x+5/2,y-1/2,-z+1 |
4_746 |
23 |
5 |
15368 |
153.0 |
0.4 |
0.718 |
4 |
0 |
0 |
0.000 |
19 |
|
2 |
14 |
5 |
15368 |
◊ |
D |
-x+5/2,y-1/2,-z |
4_745 |
15 |
6 |
17943 |
139.8 |
-0.9 |
0.537 |
0 |
0 |
0 |
0.011 |
20 |
|
[GOL]D:703 |
6 |
1 |
223 |
f |
D |
x,y,z |
1_555 |
19 |
11 |
17943 |
117.2 |
-0.2 |
0.572 |
3 |
0 |
0 |
0.046 |
21 |
|
[EDO]1:404 |
4 |
1 |
184 |
◊ |
1 |
x,y,z |
1_555 |
23 |
9 |
15582 |
117.0 |
2.7 |
0.558 |
3 |
0 |
0 |
0.000 |
22 |
|
2 |
11 |
5 |
15368 |
◊ |
1 |
-x+2,y,-z+1 |
2_756 |
11 |
5 |
15582 |
104.3 |
-2.4 |
0.211 |
0 |
0 |
0 |
0.021 |
23 |
|
C |
16 |
5 |
15921 |
◊ |
1 |
x,y,z |
1_555 |
10 |
3 |
15582 |
103.2 |
0.5 |
0.780 |
1 |
2 |
0 |
0.002 |
24 |
|
[SO4]1:402 |
5 |
1 |
187 |
f |
1 |
x,y,z |
1_555 |
15 |
5 |
15582 |
91.1 |
-13.5 |
0.825 |
4 |
0 |
0 |
0.417 |
25 |
|
[EDO]2:402 |
4 |
1 |
185 |
◊ |
2 |
x,y,z |
1_555 |
13 |
6 |
15368 |
90.8 |
2.7 |
0.511 |
2 |
0 |
0 |
0.000 |
26 |
|
D |
9 |
3 |
17943 |
x |
D |
-x+5/2,y-1/2,-z |
4_745 |
13 |
5 |
17943 |
87.5 |
-1.4 |
0.260 |
0 |
0 |
0 |
0.000 |
27 |
|
2 |
10 |
5 |
15368 |
◊ |
C |
x,y-1,z |
1_545 |
11 |
3 |
15921 |
79.4 |
-1.2 |
0.425 |
1 |
0 |
0 |
0.000 |
28 |
|
[EDO]1:405 |
4 |
1 |
184 |
◊ |
2 |
x,y,z |
1_555 |
12 |
6 |
15368 |
78.3 |
2.1 |
0.287 |
1 |
0 |
0 |
0.000 |
29 |
|
[EDO]D:701 |
4 |
1 |
182 |
f |
D |
x,y,z |
1_555 |
15 |
7 |
17943 |
78.2 |
1.6 |
0.282 |
6 |
0 |
0 |
0.031 |
30 |
|
[EDO]2:403 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
13 |
3 |
17943 |
77.2 |
2.4 |
0.451 |
0 |
0 |
0 |
0.000 |
31 |
|
[EDO]1:405 |
3 |
1 |
184 |
f |
1 |
x,y,z |
1_555 |
8 |
6 |
15582 |
74.1 |
2.8 |
0.670 |
3 |
0 |
0 |
0.000 |
32 |
|
[EDO]2:404 |
4 |
1 |
184 |
◊ |
2 |
x,y,z |
1_555 |
15 |
7 |
15368 |
72.2 |
1.5 |
0.863 |
3 |
0 |
0 |
0.000 |
33 |
|
[EDO]D:701 |
4 |
1 |
182 |
◊ |
2 |
x,y,z |
1_555 |
12 |
4 |
15368 |
71.8 |
2.0 |
0.277 |
1 |
0 |
0 |
0.000 |
34 |
|
[EDO]2:404 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
9 |
4 |
17943 |
70.2 |
3.3 |
0.345 |
2 |
0 |
0 |
0.000 |
35 |
|
[EDO]2:403 |
4 |
1 |
184 |
f |
2 |
x,y,z |
1_555 |
8 |
4 |
15368 |
68.3 |
1.8 |
0.888 |
3 |
0 |
0 |
0.000 |
36 |
|
[CL]D:702 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
17943 |
64.7 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.277 |
37 |
|
2 |
8 |
5 |
15368 |
◊ |
C |
-x+2,y-1,-z+1 |
2_746 |
9 |
4 |
15921 |
64.1 |
-1.5 |
0.322 |
0 |
0 |
0 |
0.000 |
38 |
|
[CL]1:403 |
1 |
1 |
125 |
f |
1 |
x,y,z |
1_555 |
13 |
4 |
15582 |
63.8 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.240 |
39 |
|
1 |
8 |
2 |
15582 |
◊ |
1 |
-x+2,y,-z+2 |
2_757 |
8 |
2 |
15582 |
62.2 |
0.7 |
0.820 |
0 |
0 |
0 |
0.000 |
40 |
|
[FMN]C:401 |
13 |
1 |
618 |
◊ |
[EDO]C:402 |
x,y,z |
1_555 |
4 |
1 |
184 |
59.4 |
1.6 |
0.840 |
1 |
0 |
0 |
0.000 |
41 |
|
[EDO]C:402 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
8 |
5 |
15921 |
59.0 |
1.5 |
0.891 |
3 |
0 |
0 |
0.000 |
42 |
|
[EDO]2:402 |
3 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
11 |
3 |
17943 |
58.3 |
1.2 |
0.237 |
0 |
0 |
0 |
0.000 |
43 |
|
1 |
3 |
2 |
15582 |
◊ |
D |
-x+5/2,y-1/2,-z+1 |
4_746 |
11 |
6 |
17943 |
55.6 |
1.4 |
0.851 |
0 |
2 |
0 |
0.000 |
44 |
|
D |
1 |
1 |
17943 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
2413 |
33.7 |
-0.7 |
0.147 |
0 |
0 |
0 |
0.005 |
45 |
|
2 |
5 |
2 |
15368 |
◊ |
D |
x,y-1,z |
1_545 |
5 |
3 |
17943 |
26.8 |
-0.2 |
0.548 |
0 |
0 |
0 |
0.000 |
46 |
|
[CL]1:403 |
1 |
1 |
125 |
◊ |
1 |
-x+2,y,-z+2 |
2_757 |
2 |
1 |
15582 |
25.2 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.030 |
47 |
|
[EDO]C:402 |
4 |
1 |
184 |
◊ |
C |
-x+2,y,-z+1 |
2_756 |
6 |
4 |
15921 |
22.5 |
1.2 |
0.936 |
0 |
0 |
0 |
0.000 |
48 |
|
[SO4]1:402 |
2 |
1 |
187 |
◊ |
C |
-x+2,y,-z+1 |
2_756 |
1 |
1 |
15921 |
7.4 |
-0.8 |
0.850 |
0 |
0 |
0 |
0.016 |
49 |
|
[EDO]2:404 |
3 |
1 |
184 |
f |
1 |
-x+5/2,y-1/2,-z+1 |
4_746 |
2 |
1 |
15582 |
5.8 |
0.0 |
0.705 |
0 |
0 |
0 |
0.000 |
50 |
|
[EDO]1:404 |
1 |
1 |
184 |
f |
C |
-x+2,y,-z+1 |
2_756 |
1 |
1 |
15921 |
4.1 |
0.1 |
0.881 |
0 |
0 |
0 |
0.000 |
|