## |
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 |
|
D |
85 |
25 |
5116 |
◊ |
D |
-x,y,-z |
2_555 |
85 |
25 |
5116 |
809.5 |
-9.0 |
0.822 |
4 |
0 |
0 |
0.078 |
2 |
2 |
|
F |
68 |
16 |
4016 |
◊ |
E |
x,y,z |
1_555 |
67 |
19 |
5148 |
743.7 |
-8.9 |
0.742 |
6 |
5 |
0 |
0.087 |
3 |
3 |
|
F |
68 |
17 |
4016 |
◊ |
C |
x,y,z |
1_555 |
72 |
22 |
8546 |
736.2 |
-8.9 |
0.432 |
11 |
6 |
0 |
0.220 |
4 |
4 |
|
D |
68 |
17 |
5116 |
◊ |
A |
x,y,z |
1_555 |
72 |
21 |
8641 |
716.0 |
-8.7 |
0.422 |
9 |
6 |
0 |
0.218 |
5 |
5 |
|
E |
68 |
17 |
5148 |
◊ |
B |
x,y,z |
1_555 |
71 |
22 |
8563 |
693.3 |
-9.8 |
0.351 |
7 |
4 |
0 |
0.236 |
6 |
6 |
|
B |
62 |
18 |
8563 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
51 |
19 |
8641 |
499.7 |
3.5 |
0.873 |
7 |
8 |
0 |
0.000 |
7 |
7 |
|
[GTP]B:200 |
32 |
1 |
636 |
f |
B |
x,y,z |
1_555 |
58 |
23 |
8563 |
422.9 |
-4.4 |
0.477 |
20 |
0 |
0 |
0.232 |
8 |
|
[GTP]A:200 |
31 |
1 |
639 |
f |
A |
x,y,z |
1_555 |
63 |
25 |
8641 |
422.4 |
-4.2 |
0.528 |
21 |
0 |
0 |
0.232 |
9 |
|
[GTP]C:200 |
31 |
1 |
640 |
f |
C |
x,y,z |
1_555 |
60 |
23 |
8546 |
407.6 |
-3.9 |
0.536 |
20 |
0 |
0 |
0.232 |
Average: |
417.6 |
-4.2 |
0.514 |
20 |
0 |
0 |
0.232 |
8 |
10 |
|
B |
39 |
13 |
8563 |
x |
B |
-x-1/2,y-1/2,-z |
4_445 |
39 |
12 |
8563 |
369.2 |
-2.3 |
0.351 |
3 |
0 |
0 |
0.000 |
9 |
11 |
|
C |
40 |
9 |
8546 |
◊ |
A |
x,y,z |
1_555 |
49 |
13 |
8641 |
364.6 |
-1.2 |
0.585 |
3 |
0 |
0 |
0.000 |
10 |
12 |
|
D |
31 |
8 |
5116 |
x |
D |
-x,y-1,-z |
2_545 |
34 |
10 |
5116 |
304.8 |
-5.7 |
0.551 |
0 |
0 |
0 |
0.000 |
11 |
13 |
|
E |
25 |
8 |
5148 |
x |
E |
x,y-1,z |
1_545 |
25 |
6 |
5148 |
284.6 |
-4.9 |
0.569 |
3 |
0 |
0 |
0.000 |
12 |
14 |
|
F |
28 |
8 |
4016 |
◊ |
E |
x,y-1,z |
1_545 |
26 |
8 |
5148 |
278.4 |
-4.6 |
0.584 |
1 |
0 |
0 |
0.000 |
13 |
15 |
|
B |
32 |
11 |
8563 |
◊ |
C |
-x-1/2,y-1/2,-z-1 |
4_444 |
29 |
9 |
8546 |
262.2 |
-3.6 |
0.231 |
0 |
0 |
0 |
0.000 |
14 |
16 |
|
C |
25 |
8 |
8546 |
◊ |
A |
x,y,z-1 |
1_554 |
27 |
9 |
8641 |
231.4 |
1.4 |
0.771 |
3 |
2 |
0 |
0.000 |
15 |
17 |
|
D |
24 |
5 |
5116 |
◊ |
A |
-x,y,-z |
2_555 |
21 |
6 |
8641 |
223.7 |
-1.0 |
0.366 |
2 |
1 |
0 |
0.029 |
16 |
18 |
|
E |
23 |
4 |
5148 |
◊ |
C |
x,y,z |
1_555 |
17 |
5 |
8546 |
207.9 |
-2.3 |
0.281 |
2 |
0 |
0 |
0.022 |
17 |
19 |
|
F |
23 |
6 |
4016 |
◊ |
B |
x,y,z |
1_555 |
19 |
6 |
8563 |
183.8 |
-1.2 |
0.225 |
2 |
0 |
0 |
0.014 |
18 |
20 |
|
D |
13 |
7 |
5116 |
x |
D |
x,y-1,z |
1_545 |
19 |
4 |
5116 |
180.0 |
-4.4 |
0.311 |
0 |
0 |
0 |
0.000 |
19 |
21 |
|
F |
19 |
4 |
4016 |
◊ |
A |
x,y,z |
1_555 |
14 |
4 |
8641 |
132.9 |
-1.3 |
0.619 |
1 |
0 |
0 |
0.000 |
20 |
22 |
|
[MES]B:1 |
10 |
1 |
338 |
◊ |
B |
x,y,z |
1_555 |
19 |
9 |
8563 |
125.3 |
2.6 |
0.032 |
0 |
0 |
0 |
0.000 |
21 |
23 |
|
E |
12 |
4 |
5148 |
◊ |
F |
x,y-1,z |
1_545 |
9 |
3 |
4016 |
91.3 |
0.2 |
0.834 |
1 |
0 |
0 |
0.000 |
22 |
24 |
|
D |
11 |
4 |
5116 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
8546 |
90.7 |
2.3 |
0.943 |
1 |
1 |
0 |
0.000 |
23 |
25 |
|
[SO4]C:2002 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
15 |
5 |
8546 |
88.3 |
-13.8 |
0.732 |
5 |
0 |
0 |
0.239 |
24 |
26 |
|
[SO4]B:2003 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
8563 |
87.1 |
-13.2 |
0.741 |
5 |
0 |
0 |
0.269 |
27 |
|
[SO4]A:2001 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
8641 |
86.2 |
-13.2 |
0.726 |
5 |
0 |
0 |
0.269 |
Average: |
86.7 |
-13.2 |
0.733 |
5 |
0 |
0 |
0.269 |
25 |
28 |
|
[2ME]B:2 |
4 |
1 |
208 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
8563 |
83.5 |
-2.0 |
0.631 |
0 |
0 |
0 |
0.035 |
26 |
29 |
|
[SO4]C:2005 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
8546 |
77.0 |
-9.2 |
0.839 |
2 |
0 |
0 |
0.151 |
27 |
30 |
|
A |
9 |
4 |
8641 |
◊ |
B |
-x-1/2,y-1/2,-z |
4_445 |
8 |
3 |
8563 |
73.3 |
0.8 |
0.713 |
1 |
2 |
0 |
0.000 |
28 |
31 |
|
B |
7 |
3 |
8563 |
◊ |
[GTP]C:200 |
-x-1/2,y-1/2,-z-1 |
4_444 |
9 |
1 |
640 |
68.9 |
0.5 |
0.708 |
2 |
0 |
0 |
0.000 |
29 |
32 |
|
[SO4]B:2004 |
4 |
1 |
185 |
f |
A |
-x-1/2,y-1/2,-z |
4_445 |
5 |
2 |
8641 |
54.3 |
-5.8 |
0.956 |
2 |
0 |
0 |
0.107 |
30 |
33 |
|
[MES]B:1 |
5 |
1 |
338 |
◊ |
F |
x,y,z |
1_555 |
6 |
3 |
4016 |
45.4 |
0.9 |
0.042 |
0 |
0 |
0 |
0.000 |
31 |
34 |
|
[SO4]C:2005 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
8641 |
43.0 |
-5.4 |
0.644 |
0 |
0 |
0 |
0.000 |
32 |
35 |
|
[SO4]B:2004 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
8563 |
43.0 |
-4.7 |
0.887 |
1 |
0 |
0 |
0.000 |
33 |
36 |
|
[MG]C:201 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
14 |
8 |
8546 |
41.4 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.101 |
37 |
|
[MG]A:201 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
8641 |
41.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.101 |
38 |
|
[MG]B:201 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
8563 |
41.2 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.101 |
Average: |
41.3 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.101 |
34 |
39 |
|
B |
5 |
3 |
8563 |
◊ |
E |
-x-1/2,y-1/2,-z-1 |
4_444 |
3 |
2 |
5148 |
40.8 |
-1.1 |
0.307 |
0 |
0 |
0 |
0.000 |
35 |
40 |
|
[GTP]A:200 |
4 |
1 |
639 |
f |
[MG]A:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.2 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.079 |
41 |
|
[GTP]B:200 |
5 |
1 |
636 |
f |
[MG]B:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.0 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.079 |
42 |
|
[GTP]C:200 |
5 |
1 |
640 |
f |
[MG]C:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
33.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.079 |
Average: |
33.9 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.079 |
36 |
43 |
|
[MES]B:1 |
4 |
1 |
338 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
5148 |
33.7 |
0.3 |
0.084 |
0 |
0 |
0 |
0.000 |
37 |
44 |
|
[SO4]A:2001 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
5116 |
23.0 |
-2.7 |
0.666 |
0 |
0 |
0 |
0.044 |
38 |
45 |
|
[SO4]B:2003 |
4 |
1 |
185 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
5148 |
22.7 |
-2.7 |
0.679 |
0 |
0 |
0 |
0.047 |
39 |
46 |
|
[SO4]C:2002 |
4 |
1 |
186 |
◊ |
F |
x,y,z |
1_555 |
3 |
2 |
4016 |
21.7 |
-2.6 |
0.683 |
0 |
0 |
0 |
0.038 |
40 |
47 |
|
B |
5 |
2 |
8563 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
8641 |
20.0 |
-0.1 |
0.541 |
0 |
0 |
0 |
0.000 |
41 |
48 |
|
C |
2 |
1 |
8546 |
◊ |
D |
-x,y-1,-z |
2_545 |
1 |
1 |
5116 |
13.7 |
-0.2 |
0.409 |
0 |
0 |
0 |
0.000 |
42 |
49 |
|
B |
3 |
2 |
8563 |
◊ |
E |
x,y-1,z |
1_545 |
2 |
1 |
5148 |
5.1 |
-0.0 |
0.629 |
0 |
0 |
0 |
0.000 |
43 |
50 |
|
[SO4]C:2005 |
1 |
1 |
185 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
4016 |
3.5 |
-0.5 |
0.711 |
0 |
0 |
0 |
0.007 |
44 |
51 |
|
A |
1 |
1 |
8641 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
5116 |
3.4 |
-0.0 |
0.603 |
0 |
0 |
0 |
0.000 |
45 |
52 |
|
[MES]B:1 |
1 |
1 |
338 |
f |
E |
x,y-1,z |
1_545 |
1 |
1 |
5148 |
2.5 |
-0.0 |
0.212 |
0 |
0 |
0 |
0.100 |
|