| ## |
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 |
|
C |
87 |
24 |
17839 |
◊ |
A |
x,y,z |
1_555 |
83 |
22 |
17872 |
761.6 |
0.3 |
0.598 |
16 |
2 |
0 |
0.000 |
2 |
|
D |
83 |
23 |
18002 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
79 |
23 |
18228 |
706.6 |
-0.4 |
0.515 |
12 |
2 |
0 |
0.000 |
| Average: |
734.1 |
-0.0 |
0.557 |
14 |
2 |
0 |
0.000 |
| 2 |
3 |
|
B |
84 |
23 |
18228 |
◊ |
A |
x,y,z |
1_555 |
88 |
22 |
17872 |
754.8 |
-8.1 |
0.069 |
5 |
0 |
0 |
0.000 |
| 3 |
4 |
|
B |
79 |
19 |
18228 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
79 |
20 |
17872 |
694.6 |
-2.5 |
0.350 |
11 |
0 |
0 |
0.000 |
| 4 |
5 |
|
D |
65 |
15 |
18002 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
67 |
17 |
17839 |
595.0 |
-1.6 |
0.433 |
12 |
0 |
0 |
0.000 |
| 5 |
6 |
|
D |
55 |
16 |
18002 |
◊ |
C |
x,y,z |
1_555 |
54 |
16 |
17839 |
451.7 |
-5.6 |
0.105 |
0 |
0 |
0 |
0.051 |
| 6 |
7 |
|
B |
49 |
15 |
18228 |
◊ |
D |
x-1,y,z |
1_455 |
55 |
17 |
18002 |
433.4 |
1.2 |
0.649 |
4 |
3 |
0 |
0.000 |
| 7 |
8 |
|
C |
45 |
15 |
17839 |
◊ |
B |
x,y,z |
1_555 |
45 |
13 |
18228 |
403.3 |
2.7 |
0.773 |
5 |
3 |
0 |
0.000 |
9 |
|
D |
48 |
16 |
18002 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
47 |
15 |
17872 |
396.4 |
1.5 |
0.688 |
3 |
2 |
0 |
0.000 |
| Average: |
399.8 |
2.1 |
0.730 |
4 |
3 |
0 |
0.000 |
| 8 |
10 |
|
B |
46 |
15 |
18228 |
◊ |
C |
x-1,y,z |
1_455 |
47 |
12 |
17839 |
381.0 |
-1.9 |
0.362 |
5 |
1 |
0 |
0.000 |
| 9 |
11 |
|
[P6G]B:485 |
17 |
1 |
541 |
◊ |
B |
x,y,z |
1_555 |
52 |
17 |
18228 |
293.9 |
1.3 |
0.370 |
0 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[P6G]A:485 |
19 |
1 |
502 |
f |
A |
x,y,z |
1_555 |
54 |
15 |
17872 |
281.7 |
2.1 |
0.428 |
0 |
0 |
0 |
0.000 |
| 11 |
13 |
|
D |
26 |
7 |
18002 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
28 |
10 |
17872 |
233.5 |
0.0 |
0.559 |
3 |
1 |
0 |
0.000 |
| 12 |
14 |
|
C |
26 |
9 |
17839 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
24 |
10 |
17872 |
197.5 |
2.2 |
0.812 |
1 |
2 |
0 |
0.000 |
| 13 |
15 |
|
A |
25 |
10 |
17872 |
◊ |
D |
x-1,y,z-1 |
1_454 |
18 |
7 |
18002 |
181.8 |
1.8 |
0.765 |
0 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[PGE]C:486 |
10 |
1 |
334 |
◊ |
C |
x,y,z |
1_555 |
34 |
11 |
17839 |
169.3 |
5.2 |
0.325 |
0 |
0 |
0 |
0.000 |
| 15 |
17 |
|
C |
23 |
8 |
17839 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
20 |
7 |
18002 |
164.7 |
1.6 |
0.766 |
2 |
1 |
0 |
0.000 |
| 16 |
18 |
|
C |
18 |
7 |
17839 |
◊ |
D |
x-1,y,z |
1_455 |
12 |
4 |
18002 |
151.3 |
0.1 |
0.545 |
1 |
0 |
0 |
0.000 |
| 17 |
19 |
|
A |
18 |
6 |
17872 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
21 |
8 |
18228 |
147.9 |
1.6 |
0.759 |
1 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[PGE]C:485 |
10 |
1 |
334 |
◊ |
C |
x,y,z |
1_555 |
18 |
10 |
17839 |
142.2 |
3.3 |
0.174 |
3 |
0 |
0 |
0.000 |
| 19 |
21 |
|
[PEG]D:485 |
7 |
1 |
260 |
f |
D |
x,y,z |
1_555 |
32 |
9 |
18002 |
129.1 |
3.2 |
0.337 |
0 |
0 |
0 |
0.000 |
| 20 |
22 |
|
[PEG]C:487 |
6 |
1 |
260 |
◊ |
C |
x,y,z |
1_555 |
21 |
7 |
17839 |
116.1 |
3.9 |
0.432 |
0 |
0 |
0 |
0.000 |
| 21 |
23 |
|
[SO4]C:5 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
14 |
5 |
17839 |
105.4 |
-13.6 |
0.853 |
2 |
0 |
0 |
0.131 |
| 22 |
24 |
|
[SO4]D:4 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
15 |
5 |
18002 |
102.4 |
-13.5 |
0.838 |
0 |
0 |
0 |
0.122 |
| 23 |
25 |
|
[SO4]D:2 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
15 |
6 |
18002 |
100.2 |
-14.8 |
0.679 |
3 |
0 |
0 |
0.146 |
| 24 |
26 |
|
[SO4]C:488 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
15 |
5 |
17839 |
99.9 |
-14.4 |
0.704 |
3 |
0 |
0 |
0.142 |
| 25 |
27 |
|
[SO4]D:3 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
18002 |
96.1 |
-12.8 |
0.885 |
4 |
0 |
0 |
0.132 |
| 26 |
28 |
|
C |
9 |
3 |
17839 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
7 |
3 |
17872 |
66.2 |
1.1 |
0.792 |
1 |
0 |
0 |
0.000 |
| 27 |
29 |
|
B |
8 |
4 |
18228 |
◊ |
A |
x-1,y,z |
1_455 |
9 |
4 |
17872 |
60.2 |
-0.2 |
0.495 |
1 |
0 |
0 |
0.000 |
| 28 |
30 |
|
C |
6 |
2 |
17839 |
◊ |
D |
x,y,z-1 |
1_554 |
6 |
2 |
18002 |
57.8 |
-0.2 |
0.489 |
1 |
0 |
0 |
0.000 |
| 29 |
31 |
|
B |
8 |
4 |
18228 |
◊ |
D |
x-1,y,z-1 |
1_454 |
10 |
4 |
18002 |
49.6 |
0.2 |
0.597 |
0 |
0 |
0 |
0.000 |
| 30 |
32 |
|
[CA]D:1 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
7 |
7 |
18002 |
43.7 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.232 |
33 |
|
[CA]A:1 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
6 |
17872 |
43.6 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.232 |
34 |
|
[CA]C:1 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
9 |
7 |
17839 |
43.5 |
-13.0 |
0.000 |
0 |
0 |
0 |
0.232 |
35 |
|
[CA]B:1 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
5 |
5 |
18228 |
42.9 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.232 |
| Average: |
43.4 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.232 |
| 31 |
36 |
|
D |
9 |
2 |
18002 |
f |
[PEG]C:487 |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
1 |
260 |
42.6 |
0.2 |
0.250 |
0 |
0 |
0 |
0.000 |
| 32 |
37 |
|
[SO4]D:2 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
17839 |
41.4 |
-4.7 |
0.903 |
1 |
0 |
0 |
0.046 |
| 33 |
38 |
|
[SO4]C:488 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
5 |
1 |
18002 |
38.6 |
-4.4 |
0.892 |
1 |
0 |
0 |
0.043 |
| 34 |
39 |
|
[SO4]D:3 |
3 |
1 |
184 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
17872 |
36.4 |
-4.1 |
0.609 |
1 |
0 |
0 |
0.000 |
| 35 |
40 |
|
A |
3 |
1 |
17872 |
◊ |
B |
x,y,z-1 |
1_554 |
7 |
3 |
18228 |
35.8 |
-0.4 |
0.436 |
0 |
0 |
0 |
0.000 |
| 36 |
41 |
|
[P6G]B:485 |
3 |
1 |
541 |
f |
A |
-x,y-1/2,-z |
2_545 |
9 |
2 |
17872 |
33.8 |
0.5 |
0.511 |
0 |
0 |
0 |
0.000 |
| 37 |
42 |
|
C |
5 |
3 |
17839 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
8 |
5 |
18228 |
28.4 |
0.8 |
0.750 |
0 |
0 |
0 |
0.000 |
| 38 |
43 |
|
[SO4]D:4 |
2 |
1 |
185 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
6 |
2 |
18228 |
27.0 |
-3.4 |
0.745 |
0 |
0 |
0 |
0.000 |
| 39 |
44 |
|
[PGE]C:486 |
2 |
1 |
334 |
f |
[PGE]C:485 |
x,y,z |
1_555 |
6 |
1 |
334 |
21.8 |
1.2 |
0.080 |
0 |
0 |
0 |
0.000 |
| 40 |
45 |
|
[SO4]C:5 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
17872 |
16.9 |
-2.1 |
0.703 |
0 |
0 |
0 |
0.000 |
| 41 |
46 |
|
D |
3 |
1 |
18002 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
18228 |
13.7 |
0.7 |
0.838 |
0 |
0 |
0 |
0.000 |
| 42 |
47 |
|
[PEG]C:487 |
1 |
1 |
260 |
f |
[PGE]C:486 |
x,y,z |
1_555 |
2 |
1 |
334 |
10.7 |
0.4 |
0.233 |
0 |
0 |
0 |
0.000 |
| 43 |
48 |
|
C |
1 |
1 |
17839 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
18228 |
4.7 |
0.1 |
0.730 |
0 |
0 |
0 |
0.000 |
|