## |
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 |
|
B |
96 |
26 |
7819 |
◊ |
B |
x-y,-y,-z+2/3 |
5_555 |
96 |
26 |
7819 |
944.1 |
-21.5 |
0.085 |
6 |
0 |
0 |
0.241 |
2 |
2 |
|
B |
86 |
23 |
7819 |
◊ |
A |
x,y,z |
1_555 |
105 |
30 |
14352 |
891.4 |
-10.4 |
0.376 |
12 |
1 |
0 |
0.061 |
3 |
3 |
|
A |
73 |
21 |
14352 |
◊ |
A |
x-y,-y,-z+2/3 |
5_555 |
73 |
21 |
14352 |
748.5 |
-9.2 |
0.184 |
6 |
0 |
0 |
0.021 |
4 |
4 |
|
[GTA]A:7113 |
49 |
1 |
887 |
f |
A |
x,y,z |
1_555 |
73 |
23 |
14352 |
546.8 |
-1.1 |
0.739 |
19 |
0 |
0 |
0.039 |
5 |
5 |
|
A |
43 |
14 |
14352 |
x |
A |
-y+1,x-y,z+1/3 |
2_655 |
42 |
12 |
14352 |
364.5 |
-6.2 |
0.157 |
2 |
0 |
0 |
0.000 |
6 |
6 |
|
A |
39 |
11 |
14352 |
◊ |
B |
-y+1,x-y,z+1/3 |
2_655 |
36 |
11 |
7819 |
358.4 |
-3.7 |
0.433 |
3 |
4 |
0 |
0.023 |
7 |
7 |
|
[MGP]A:7114 |
18 |
1 |
617 |
f |
A |
x,y,z |
1_555 |
27 |
10 |
14352 |
184.4 |
-0.1 |
0.620 |
6 |
0 |
0 |
0.011 |
8 |
8 |
|
A |
15 |
5 |
14352 |
x |
A |
x,y,z-1 |
1_554 |
18 |
5 |
14352 |
125.6 |
-0.2 |
0.649 |
0 |
0 |
0 |
0.000 |
9 |
9 |
|
[SO4]A:7120 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
14352 |
107.7 |
-19.5 |
0.553 |
6 |
0 |
0 |
0.091 |
10 |
10 |
|
[MGP]A:7114 |
11 |
1 |
617 |
◊ |
B |
-y+1,x-y,z+1/3 |
2_655 |
10 |
2 |
7819 |
91.8 |
-2.5 |
0.311 |
0 |
0 |
0 |
0.010 |
11 |
11 |
|
[ADE]A:7116 |
10 |
1 |
271 |
f |
A |
x,y,z |
1_555 |
13 |
3 |
14352 |
91.6 |
1.0 |
0.071 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
[SO4]A:7119 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
14352 |
91.1 |
-11.2 |
0.900 |
3 |
0 |
0 |
0.052 |
13 |
13 |
|
[ADE]A:7115 |
10 |
1 |
270 |
f |
A |
x,y,z |
1_555 |
14 |
3 |
14352 |
89.5 |
0.9 |
0.091 |
0 |
0 |
0 |
0.000 |
14 |
14 |
|
[SO4]A:7117 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
14352 |
84.8 |
-11.8 |
0.721 |
2 |
0 |
0 |
0.052 |
15 |
15 |
|
[SO4]A:7118 |
5 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
14352 |
80.0 |
-10.6 |
0.835 |
1 |
0 |
0 |
0.045 |
16 |
16 |
|
[SO4]B:4407 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
7819 |
72.9 |
-10.3 |
0.861 |
2 |
0 |
0 |
0.223 |
17 |
17 |
|
[SO4]A:7124 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
14352 |
70.1 |
-9.6 |
0.749 |
0 |
0 |
0 |
0.039 |
18 |
18 |
|
[SO4]B:4406 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
7819 |
67.5 |
-8.6 |
0.908 |
2 |
0 |
0 |
0.190 |
19 |
19 |
|
[CL]A:7102 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
14352 |
66.9 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.034 |
20 |
20 |
|
[SO4]A:7121 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
14352 |
63.3 |
-8.9 |
0.745 |
1 |
0 |
0 |
0.038 |
21 |
21 |
|
[CL]B:4405 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
7819 |
61.5 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.180 |
22 |
22 |
|
[SO4]A:7122 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
14352 |
61.1 |
-8.2 |
0.809 |
2 |
0 |
0 |
0.037 |
23 |
23 |
|
[SO4]A:7123 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
14352 |
60.1 |
-6.1 |
0.970 |
4 |
0 |
0 |
0.032 |
24 |
24 |
|
[SO4]B:4406 |
5 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
14352 |
59.8 |
-7.1 |
0.907 |
1 |
0 |
0 |
0.029 |
25 |
25 |
|
[CL]B:4403 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
7819 |
59.5 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.166 |
26 |
26 |
|
[CL]A:7107 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
14352 |
58.1 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.034 |
27 |
27 |
|
[CL]A:7101 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
14352 |
55.1 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.029 |
28 |
28 |
|
[CL]A:7105 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
14352 |
53.5 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.032 |
29 |
29 |
|
[CL]A:7103 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
14352 |
52.8 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.050 |
30 |
|
[CL]A:7104 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
14352 |
43.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.050 |
Average: |
48.1 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.050 |
30 |
31 |
|
[CL]A:7106 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
14352 |
52.5 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.029 |
31 |
32 |
|
A |
8 |
3 |
14352 |
◊ |
[ADE]A:7115 |
-y+1,x-y,z+1/3 |
2_655 |
5 |
1 |
270 |
51.4 |
0.7 |
0.190 |
0 |
0 |
0 |
0.000 |
32 |
33 |
|
[CL]A:7110 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
14352 |
51.2 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.028 |
33 |
34 |
|
[SO4]A:7117 |
4 |
1 |
183 |
f |
[GTA]A:7113 |
x,y,z |
1_555 |
9 |
1 |
887 |
50.1 |
-7.7 |
0.636 |
1 |
0 |
0 |
0.034 |
34 |
35 |
|
[CL]A:7109 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
14352 |
46.0 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.024 |
35 |
36 |
|
[CL]A:7102 |
1 |
1 |
125 |
◊ |
[ADE]A:7115 |
-y+1,x-y,z+1/3 |
2_655 |
6 |
1 |
270 |
38.2 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
37 |
|
A |
4 |
2 |
14352 |
f |
[CL]A:7108 |
x,y,z-1 |
1_554 |
1 |
1 |
125 |
35.9 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.015 |
37 |
38 |
|
B |
4 |
1 |
7819 |
◊ |
A |
x-y,-y,-z+2/3 |
5_555 |
5 |
3 |
14352 |
35.6 |
0.5 |
0.791 |
0 |
0 |
0 |
0.000 |
38 |
39 |
|
A |
2 |
1 |
14352 |
f |
[CL]A:7111 |
-y+1,x-y,z+1/3 |
2_655 |
1 |
1 |
125 |
34.0 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.017 |
39 |
40 |
|
[CL]A:7108 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
14352 |
32.9 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.000 |
40 |
41 |
|
[CL]A:7105 |
1 |
1 |
125 |
◊ |
B |
-y+1,x-y,z+1/3 |
2_655 |
8 |
4 |
7819 |
31.1 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.014 |
41 |
42 |
|
A |
3 |
2 |
14352 |
◊ |
A |
x-y,-y,-z+5/3 |
5_556 |
3 |
2 |
14352 |
29.5 |
-0.1 |
0.550 |
0 |
0 |
0 |
0.000 |
42 |
43 |
|
[CL]A:7111 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
14352 |
29.4 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.000 |
43 |
44 |
|
[CL]B:4404 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
14352 |
28.1 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.011 |
44 |
45 |
|
[CL]A:7105 |
1 |
1 |
125 |
◊ |
A |
-y+1,x-y,z+1/3 |
2_655 |
1 |
1 |
14352 |
18.2 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
45 |
46 |
|
[SO4]A:7121 |
4 |
1 |
183 |
◊ |
[CL]A:7111 |
x,y,z |
1_555 |
1 |
1 |
125 |
15.4 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.000 |
46 |
47 |
|
[CL]A:7104 |
1 |
1 |
125 |
f |
[CL]A:7103 |
x,y,z |
1_555 |
1 |
1 |
125 |
14.5 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.012 |
47 |
48 |
|
[SO4]B:4406 |
2 |
1 |
184 |
◊ |
[SO4]A:7121 |
x,y,z |
1_555 |
2 |
1 |
183 |
12.9 |
-3.1 |
0.960 |
0 |
0 |
0 |
0.012 |
48 |
49 |
|
[SO4]A:7121 |
3 |
1 |
183 |
f |
[CL]A:7106 |
x,y,z |
1_555 |
1 |
1 |
125 |
11.9 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.010 |
49 |
50 |
|
[CL]B:4404 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
7819 |
11.2 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.004 |
50 |
51 |
|
[MGP]A:7114 |
1 |
1 |
617 |
◊ |
[SO4]B:4407 |
-y+1,x-y,z+1/3 |
2_655 |
1 |
1 |
183 |
11.2 |
-1.9 |
0.412 |
0 |
0 |
0 |
0.008 |
51 |
52 |
|
[SO4]B:4406 |
2 |
1 |
184 |
◊ |
[CL]B:4404 |
x,y,z |
1_555 |
1 |
1 |
125 |
8.0 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.007 |
52 |
53 |
|
[SO4]B:4407 |
1 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
14352 |
7.7 |
-1.0 |
0.648 |
0 |
0 |
0 |
0.004 |
53 |
54 |
|
A |
1 |
1 |
14352 |
◊ |
[CL]B:4404 |
-y+1,x-y,z+1/3 |
2_655 |
1 |
1 |
125 |
1.3 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
54 |
55 |
|
[CL]B:4404 |
1 |
1 |
125 |
◊ |
[CL]A:7111 |
x,y,z |
1_555 |
1 |
1 |
125 |
1.2 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
|