## |
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 |
|
B |
126 |
33 |
6280 |
◊ |
A |
x,y,z |
1_555 |
137 |
41 |
14084 |
1258.0 |
-15.9 |
0.228 |
17 |
2 |
0 |
0.771 |
2 |
|
C |
108 |
24 |
17702 |
◊ |
A |
x,y,z |
1_555 |
121 |
42 |
14084 |
1118.2 |
-11.8 |
0.155 |
16 |
7 |
0 |
0.436 |
3 |
|
A |
93 |
25 |
14084 |
x |
A |
-x,y-1/2,-z |
2_545 |
75 |
25 |
14084 |
830.0 |
-5.0 |
0.286 |
11 |
2 |
0 |
0.000 |
4 |
|
C |
44 |
9 |
17702 |
◊ |
B |
x,y,z |
1_555 |
58 |
18 |
6280 |
491.9 |
-12.3 |
0.023 |
1 |
1 |
0 |
0.407 |
5 |
|
B |
37 |
7 |
6280 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
44 |
12 |
17702 |
348.2 |
-2.9 |
0.500 |
3 |
0 |
0 |
0.000 |
6 |
|
C |
42 |
15 |
17702 |
x |
C |
-x+1,y-1/2,-z+1 |
2_646 |
41 |
14 |
17702 |
338.0 |
-0.4 |
0.578 |
2 |
0 |
0 |
0.000 |
7 |
|
A |
37 |
11 |
14084 |
x |
A |
x,y-1,z |
1_545 |
23 |
5 |
14084 |
285.2 |
-2.6 |
0.217 |
5 |
0 |
0 |
0.000 |
8 |
|
A |
28 |
9 |
14084 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
30 |
10 |
17702 |
267.7 |
0.1 |
0.693 |
8 |
1 |
0 |
0.000 |
9 |
|
C |
17 |
6 |
17702 |
x |
C |
-x,y-1/2,-z+1 |
2_546 |
18 |
5 |
17702 |
154.1 |
-1.9 |
0.338 |
1 |
0 |
0 |
0.000 |
10 |
|
C |
16 |
8 |
17702 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
14 |
4 |
6280 |
145.9 |
2.4 |
0.887 |
5 |
4 |
0 |
0.000 |
11 |
|
A |
16 |
7 |
14084 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
12 |
6 |
17702 |
134.7 |
-2.7 |
0.151 |
0 |
0 |
0 |
0.000 |
12 |
|
[NO3]C:405 |
4 |
1 |
168 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
17702 |
108.5 |
1.1 |
0.516 |
0 |
0 |
0 |
0.000 |
13 |
|
[NO3]C:403 |
4 |
1 |
168 |
f |
C |
x,y,z |
1_555 |
16 |
9 |
17702 |
104.4 |
1.3 |
0.532 |
2 |
0 |
0 |
0.000 |
14 |
|
[NO3]C:401 |
4 |
1 |
168 |
f |
C |
x,y,z |
1_555 |
20 |
8 |
17702 |
98.5 |
1.5 |
0.591 |
1 |
0 |
0 |
0.000 |
15 |
|
[NO3]C:402 |
4 |
1 |
167 |
◊ |
C |
x,y,z |
1_555 |
14 |
8 |
17702 |
93.5 |
0.8 |
0.487 |
1 |
0 |
0 |
0.000 |
16 |
|
[NO3]A:402 |
4 |
1 |
169 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
14084 |
89.5 |
2.0 |
0.692 |
2 |
0 |
0 |
0.000 |
17 |
|
[NO3]C:404 |
4 |
1 |
168 |
f |
C |
x,y,z |
1_555 |
19 |
8 |
17702 |
89.4 |
1.0 |
0.560 |
2 |
0 |
0 |
0.000 |
18 |
|
B |
11 |
4 |
6280 |
◊ |
C |
x,y,z-1 |
1_554 |
8 |
4 |
17702 |
81.5 |
-1.5 |
0.348 |
0 |
1 |
0 |
0.000 |
19 |
|
[NO3]A:401 |
4 |
1 |
168 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
14084 |
76.1 |
0.5 |
0.396 |
1 |
0 |
0 |
0.000 |
20 |
|
[NO3]B:301 |
4 |
1 |
167 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
6280 |
71.5 |
0.6 |
0.437 |
1 |
0 |
0 |
0.000 |
21 |
|
[NO3]C:406 |
4 |
1 |
168 |
f |
C |
x,y,z |
1_555 |
13 |
4 |
17702 |
65.8 |
0.7 |
0.429 |
1 |
0 |
0 |
0.000 |
22 |
|
[NO3]B:301 |
4 |
1 |
167 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
11 |
4 |
17702 |
63.7 |
1.2 |
0.496 |
2 |
0 |
0 |
0.000 |
23 |
|
[NO3]A:401 |
4 |
1 |
168 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
17702 |
63.3 |
0.7 |
0.412 |
1 |
0 |
0 |
0.000 |
24 |
|
C |
5 |
2 |
17702 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
7 |
4 |
6280 |
54.9 |
1.4 |
0.817 |
2 |
0 |
0 |
0.000 |
25 |
|
A |
4 |
2 |
14084 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
9 |
2 |
6280 |
54.5 |
-0.8 |
0.363 |
0 |
0 |
0 |
0.000 |
26 |
|
[MG]A:403 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
14084 |
51.7 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.274 |
27 |
|
[MG]C:408 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
17702 |
45.7 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.181 |
28 |
|
B |
5 |
2 |
6280 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
4 |
2 |
6280 |
45.0 |
-0.4 |
0.525 |
0 |
0 |
0 |
0.000 |
29 |
|
C |
5 |
1 |
17702 |
f |
[NO3]C:402 |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
1 |
167 |
40.5 |
0.7 |
0.861 |
1 |
0 |
0 |
0.000 |
30 |
|
[MG]C:411 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
17702 |
40.4 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.140 |
31 |
|
[MG]C:410 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
17702 |
37.5 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.123 |
32 |
|
[MG]C:407 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
6 |
17702 |
37.5 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.113 |
33 |
|
[MG]C:409 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
11 |
4 |
17702 |
35.2 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.125 |
34 |
|
A |
5 |
3 |
14084 |
◊ |
[MG]C:410 |
-x,y-1/2,-z |
2_545 |
1 |
1 |
98 |
31.1 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.000 |
35 |
|
B |
3 |
2 |
6280 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
4 |
2 |
17702 |
28.2 |
1.1 |
0.870 |
1 |
2 |
0 |
0.000 |
36 |
|
[MG]C:407 |
1 |
1 |
98 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
5 |
2 |
17702 |
19.8 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.000 |
37 |
|
C |
3 |
1 |
17702 |
◊ |
[MG]C:409 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
98 |
16.1 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
38 |
|
A |
1 |
1 |
14084 |
◊ |
C |
x,y,z-1 |
1_554 |
1 |
1 |
17702 |
12.8 |
0.6 |
0.901 |
0 |
0 |
0 |
0.000 |
39 |
|
C |
2 |
2 |
17702 |
x |
C |
x,y-1,z |
1_545 |
2 |
1 |
17702 |
11.7 |
0.3 |
0.790 |
0 |
0 |
0 |
0.000 |
40 |
|
[NO3]B:301 |
1 |
1 |
167 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
14084 |
5.7 |
-0.0 |
0.636 |
0 |
0 |
0 |
0.000 |
41 |
|
[MG]C:411 |
1 |
1 |
98 |
f |
[NO3]C:406 |
x,y,z |
1_555 |
2 |
1 |
168 |
5.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.015 |
|