## |
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 |
|
F |
132 |
13 |
3082 |
◊ |
D |
x,y,z |
1_555 |
145 |
47 |
27172 |
1232.1 |
-9.0 |
0.482 |
16 |
0 |
0 |
0.262 |
2 |
2 |
|
C |
120 |
13 |
2910 |
◊ |
A |
x,y,z |
1_555 |
133 |
45 |
27267 |
1123.1 |
-9.6 |
0.484 |
15 |
0 |
0 |
0.170 |
3 |
3 |
|
D |
96 |
24 |
27172 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
94 |
24 |
27267 |
847.5 |
-2.7 |
0.383 |
7 |
2 |
0 |
0.000 |
4 |
4 |
|
A |
99 |
25 |
27267 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
99 |
26 |
27267 |
792.2 |
2.2 |
0.593 |
10 |
9 |
0 |
0.000 |
5 |
5 |
|
A |
83 |
23 |
27267 |
◊ |
D |
-x,y-1/2,-z-1/2 |
3_544 |
73 |
22 |
27172 |
725.0 |
-3.0 |
0.341 |
5 |
2 |
0 |
0.038 |
6 |
6 |
|
A |
78 |
22 |
27267 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
73 |
22 |
27172 |
685.9 |
5.7 |
0.865 |
10 |
3 |
0 |
0.000 |
7 |
7 |
|
E |
66 |
6 |
1967 |
◊ |
D |
x,y,z |
1_555 |
76 |
28 |
27172 |
617.0 |
-9.8 |
0.216 |
12 |
0 |
0 |
0.263 |
8 |
|
B |
62 |
6 |
1978 |
◊ |
A |
x,y,z |
1_555 |
75 |
28 |
27267 |
597.5 |
-8.8 |
0.329 |
13 |
0 |
0 |
0.263 |
Average: |
607.3 |
-9.3 |
0.272 |
13 |
0 |
0 |
0.263 |
8 |
9 |
|
D |
46 |
14 |
27172 |
◊ |
A |
x,y,z |
1_555 |
51 |
16 |
27267 |
495.5 |
-2.0 |
0.353 |
7 |
2 |
0 |
0.038 |
9 |
10 |
|
C |
39 |
9 |
2910 |
◊ |
B |
x,y,z |
1_555 |
34 |
8 |
1978 |
379.3 |
-6.0 |
0.538 |
19 |
0 |
0 |
1.000 |
10 |
11 |
|
F |
38 |
9 |
3082 |
◊ |
E |
x,y,z |
1_555 |
34 |
8 |
1967 |
375.8 |
-5.8 |
0.501 |
19 |
0 |
0 |
1.000 |
11 |
12 |
|
D |
39 |
10 |
27172 |
x |
D |
-x+1,y-1/2,-z-1/2 |
3_644 |
45 |
11 |
27172 |
345.0 |
2.8 |
0.763 |
8 |
2 |
0 |
0.000 |
12 |
13 |
|
[NG3]A:901 |
29 |
1 |
602 |
f |
A |
x,y,z |
1_555 |
54 |
21 |
27267 |
324.9 |
-0.0 |
0.451 |
9 |
0 |
0 |
0.044 |
13 |
14 |
|
[DOC]E:9 |
14 |
1 |
416 |
◊ |
D |
x,y,z |
1_555 |
22 |
11 |
27172 |
187.0 |
1.4 |
0.454 |
2 |
0 |
0 |
0.004 |
15 |
|
[DOC]B:9 |
11 |
1 |
419 |
◊ |
A |
x,y,z |
1_555 |
26 |
10 |
27267 |
152.1 |
0.5 |
0.441 |
2 |
0 |
0 |
0.004 |
Average: |
169.6 |
1.0 |
0.448 |
2 |
0 |
0 |
0.004 |
14 |
16 |
|
E |
21 |
3 |
1967 |
◊ |
B |
x,y,z |
1_555 |
22 |
3 |
1978 |
158.2 |
3.9 |
0.842 |
0 |
0 |
0 |
0.000 |
15 |
17 |
|
D |
15 |
5 |
27172 |
x |
D |
-x,y-1/2,-z-1/2 |
3_544 |
13 |
6 |
27172 |
134.8 |
0.5 |
0.463 |
0 |
0 |
0 |
0.000 |
18 |
|
A |
10 |
4 |
27267 |
x |
A |
-x,y-1/2,-z-1/2 |
3_544 |
10 |
3 |
27267 |
81.1 |
-0.4 |
0.490 |
0 |
0 |
0 |
0.000 |
Average: |
108.0 |
0.1 |
0.477 |
0 |
0 |
0 |
0.000 |
16 |
19 |
|
A |
15 |
10 |
27267 |
◊ |
D |
x-1,y,z |
1_455 |
16 |
7 |
27172 |
126.1 |
1.8 |
0.718 |
1 |
0 |
0 |
0.000 |
17 |
20 |
|
[SO4]A:904 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
24 |
12 |
27267 |
120.6 |
-16.8 |
0.691 |
0 |
0 |
0 |
0.186 |
18 |
21 |
|
[DOC]E:9 |
14 |
1 |
416 |
cf |
E |
x,y,z |
1_555 |
16 |
1 |
1967 |
114.0 |
2.5 |
0.530 |
0 |
0 |
0 |
0.000 |
22 |
|
[DOC]B:9 |
14 |
1 |
419 |
cf |
B |
x,y,z |
1_555 |
16 |
1 |
1978 |
107.2 |
2.6 |
0.561 |
0 |
0 |
0 |
0.000 |
Average: |
110.6 |
2.6 |
0.546 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[NG3]A:901 |
13 |
1 |
602 |
◊ |
C |
x,y,z |
1_555 |
14 |
2 |
2910 |
96.7 |
1.9 |
0.714 |
3 |
0 |
0 |
0.000 |
20 |
24 |
|
[SO4]A:905 |
5 |
1 |
185 |
f |
D |
-x,y-1/2,-z-1/2 |
3_544 |
16 |
6 |
27172 |
91.3 |
-12.7 |
0.579 |
0 |
0 |
0 |
0.220 |
21 |
25 |
|
[DOC]B:9 |
13 |
1 |
419 |
◊ |
[NG3]A:901 |
x,y,z |
1_555 |
15 |
1 |
602 |
87.1 |
1.9 |
0.433 |
1 |
0 |
0 |
0.000 |
22 |
26 |
|
[SO4]A:910 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
27267 |
83.3 |
-11.9 |
0.775 |
2 |
0 |
0 |
0.141 |
23 |
27 |
|
[SO4]A:908 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
27267 |
81.8 |
-10.5 |
0.589 |
0 |
0 |
0 |
0.116 |
24 |
28 |
|
[SO4]A:909 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
27267 |
79.4 |
-10.7 |
0.825 |
2 |
0 |
0 |
0.128 |
25 |
29 |
|
F |
8 |
1 |
3082 |
◊ |
C |
x,y,z |
1_555 |
9 |
2 |
2910 |
78.8 |
3.6 |
0.898 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
[SO4]A:907 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
7 |
2 |
27172 |
76.0 |
-9.2 |
0.888 |
4 |
0 |
0 |
0.191 |
27 |
31 |
|
[SO4]A:906 |
5 |
1 |
186 |
f |
D |
-x,y-1/2,-z-1/2 |
3_544 |
12 |
5 |
27172 |
76.0 |
-9.8 |
0.804 |
1 |
0 |
0 |
0.178 |
28 |
32 |
|
[SO4]D:901 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
27172 |
74.4 |
-10.2 |
0.832 |
3 |
0 |
0 |
0.201 |
29 |
33 |
|
[SO4]A:903 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
27267 |
71.0 |
-9.3 |
0.868 |
4 |
0 |
0 |
0.122 |
30 |
34 |
|
[SO4]A:907 |
5 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
27267 |
70.1 |
-9.6 |
0.783 |
2 |
0 |
0 |
0.075 |
31 |
35 |
|
[SO4]A:908 |
5 |
1 |
184 |
◊ |
D |
-x,y-1/2,-z-1/2 |
3_544 |
13 |
4 |
27172 |
69.7 |
-9.2 |
0.643 |
0 |
0 |
0 |
0.063 |
32 |
36 |
|
[DOC]E:9 |
5 |
1 |
416 |
◊ |
F |
x,y,z |
1_555 |
9 |
2 |
3082 |
60.9 |
-0.2 |
0.454 |
3 |
0 |
0 |
0.114 |
33 |
37 |
|
[SO4]A:905 |
5 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
27267 |
57.6 |
-7.2 |
0.722 |
0 |
0 |
0 |
0.049 |
34 |
38 |
|
[DOC]B:9 |
5 |
1 |
419 |
◊ |
C |
x,y,z |
1_555 |
10 |
3 |
2910 |
57.1 |
-0.3 |
0.468 |
3 |
0 |
0 |
0.121 |
35 |
39 |
|
F |
9 |
2 |
3082 |
◊ |
B |
x,y,z |
1_555 |
8 |
1 |
1978 |
50.9 |
-1.3 |
0.487 |
0 |
0 |
0 |
0.000 |
36 |
40 |
|
C |
5 |
2 |
2910 |
◊ |
E |
x,y,z |
1_555 |
8 |
1 |
1967 |
48.5 |
-0.9 |
0.499 |
0 |
0 |
0 |
0.000 |
37 |
41 |
|
A |
2 |
1 |
27267 |
◊ |
[SO4]A:903 |
x-1/2,-y-1/2,-z |
4_445 |
4 |
1 |
185 |
42.1 |
-3.9 |
0.982 |
2 |
0 |
0 |
0.000 |
38 |
42 |
|
[CA]A:902 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
6 |
5 |
27267 |
31.6 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.075 |
39 |
43 |
|
[CA]A:902 |
1 |
1 |
85 |
f |
[NG3]A:901 |
x,y,z |
1_555 |
4 |
1 |
602 |
29.1 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.068 |
40 |
44 |
|
F |
2 |
1 |
3082 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
27267 |
28.7 |
-0.5 |
0.488 |
0 |
0 |
0 |
0.003 |
41 |
45 |
|
F |
5 |
2 |
3082 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
4 |
3 |
27267 |
17.5 |
0.3 |
0.637 |
0 |
0 |
0 |
0.000 |
42 |
46 |
|
B |
1 |
1 |
1978 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
27172 |
4.7 |
-0.3 |
0.242 |
0 |
0 |
0 |
0.000 |
47 |
|
E |
1 |
1 |
1967 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
27267 |
3.0 |
-0.1 |
0.322 |
0 |
0 |
0 |
0.000 |
Average: |
3.8 |
-0.2 |
0.282 |
0 |
0 |
0 |
0.000 |
43 |
48 |
|
[DOC]B:9 |
1 |
1 |
419 |
◊ |
[CA]A:902 |
x,y,z |
1_555 |
1 |
1 |
85 |
0.4 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|