## |
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 |
112 |
41 |
34078 |
◊ |
A |
x,y,z |
1_555 |
110 |
40 |
34138 |
959.3 |
-4.1 |
0.465 |
18 |
0 |
0 |
0.000 |
2 |
2 |
|
A |
75 |
25 |
34138 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
63 |
22 |
34138 |
576.9 |
1.9 |
0.740 |
10 |
4 |
0 |
0.000 |
3 |
|
B |
56 |
20 |
34078 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
65 |
19 |
34078 |
522.5 |
-0.3 |
0.659 |
9 |
4 |
0 |
0.000 |
Average: |
549.7 |
0.8 |
0.700 |
10 |
4 |
0 |
0.000 |
3 |
4 |
|
B |
51 |
17 |
34078 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
46 |
14 |
34138 |
399.8 |
2.4 |
0.853 |
9 |
5 |
0 |
0.000 |
4 |
5 |
|
B |
13 |
6 |
34078 |
◊ |
A |
x-1,y,z |
1_455 |
18 |
6 |
34138 |
137.8 |
0.1 |
0.450 |
1 |
0 |
0 |
0.000 |
5 |
6 |
|
[EDO]A:1015 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
34138 |
116.3 |
4.1 |
0.564 |
3 |
0 |
0 |
0.000 |
6 |
7 |
|
[EDO]A:1012 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
22 |
10 |
34138 |
114.0 |
3.4 |
0.454 |
4 |
0 |
0 |
0.000 |
7 |
8 |
|
[EDO]B:1012 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
34078 |
112.6 |
3.5 |
0.440 |
4 |
0 |
0 |
0.000 |
8 |
9 |
|
[EDO]B:1015 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
23 |
6 |
34078 |
112.0 |
2.8 |
0.410 |
0 |
0 |
0 |
0.000 |
9 |
10 |
|
[EDO]A:1011 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
34138 |
109.6 |
3.9 |
0.633 |
3 |
0 |
0 |
0.000 |
10 |
11 |
|
[EDO]B:1007 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
18 |
10 |
34078 |
108.8 |
4.1 |
0.657 |
4 |
0 |
0 |
0.000 |
11 |
12 |
|
[EDO]B:1009 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
9 |
34078 |
107.6 |
4.3 |
0.700 |
3 |
0 |
0 |
0.000 |
12 |
13 |
|
[EDO]A:1006 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
14 |
9 |
34138 |
104.4 |
4.1 |
0.659 |
3 |
0 |
0 |
0.000 |
13 |
14 |
|
[EDO]B:1014 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
21 |
8 |
34078 |
104.2 |
3.1 |
0.417 |
0 |
0 |
0 |
0.000 |
14 |
15 |
|
[EDO]A:1018 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
34138 |
103.7 |
3.9 |
0.483 |
4 |
0 |
0 |
0.000 |
15 |
16 |
|
[EDO]A:1007 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
34138 |
103.5 |
3.7 |
0.561 |
4 |
0 |
0 |
0.000 |
16 |
17 |
|
[EDO]A:1016 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
34138 |
101.5 |
2.6 |
0.438 |
2 |
0 |
0 |
0.000 |
17 |
18 |
|
[EDO]A:1020 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
34138 |
100.7 |
2.5 |
0.385 |
0 |
0 |
0 |
0.000 |
18 |
19 |
|
[EDO]A:1008 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
34138 |
100.3 |
4.2 |
0.661 |
2 |
0 |
0 |
0.000 |
19 |
20 |
|
[EDO]A:1009 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
8 |
34138 |
98.9 |
4.2 |
0.666 |
4 |
0 |
0 |
0.000 |
20 |
21 |
|
[PO4]B:1003 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
34078 |
98.1 |
-6.4 |
0.696 |
3 |
0 |
0 |
0.020 |
21 |
22 |
|
[EDO]B:1008 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
9 |
8 |
34078 |
97.5 |
4.2 |
0.668 |
4 |
0 |
0 |
0.000 |
22 |
23 |
|
[PO4]A:1004 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
34138 |
96.1 |
-6.2 |
0.705 |
4 |
0 |
0 |
0.030 |
23 |
24 |
|
[EDO]B:1016 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
34078 |
94.8 |
2.3 |
0.283 |
2 |
0 |
0 |
0.000 |
24 |
25 |
|
[EDO]A:1019 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
34138 |
93.2 |
2.3 |
0.263 |
2 |
0 |
0 |
0.000 |
25 |
26 |
|
[EDO]A:1017 |
4 |
1 |
184 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
15 |
6 |
34138 |
90.5 |
2.8 |
0.425 |
0 |
0 |
0 |
0.000 |
26 |
27 |
|
[EDO]B:1010 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
34078 |
88.7 |
1.4 |
0.159 |
1 |
0 |
0 |
0.000 |
27 |
28 |
|
[EDO]B:1013 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
34078 |
85.6 |
2.4 |
0.304 |
4 |
0 |
0 |
0.000 |
28 |
29 |
|
[EDO]B:1017 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
34078 |
84.2 |
2.6 |
0.313 |
3 |
0 |
0 |
0.000 |
29 |
30 |
|
[PO4]B:1005 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
34078 |
83.3 |
-4.0 |
0.904 |
6 |
0 |
0 |
0.017 |
30 |
31 |
|
[EDO]A:1013 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
10 |
6 |
34138 |
83.2 |
2.9 |
0.313 |
2 |
0 |
0 |
0.000 |
31 |
32 |
|
A |
11 |
4 |
34138 |
◊ |
[GAL]A:1001 |
-x+1,y-1/2,-z |
2_645 |
7 |
1 |
291 |
78.6 |
0.4 |
0.193 |
1 |
0 |
0 |
0.000 |
32 |
33 |
|
[PO4]A:1003 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
34138 |
77.6 |
-4.5 |
0.804 |
1 |
0 |
0 |
0.019 |
33 |
34 |
|
[PO4]B:1004 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
34078 |
77.0 |
-4.4 |
0.853 |
1 |
0 |
0 |
0.013 |
34 |
35 |
|
[EDO]B:1011 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
34078 |
71.2 |
1.4 |
0.785 |
2 |
0 |
0 |
0.000 |
35 |
36 |
|
[EDO]A:1014 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
34138 |
70.1 |
1.3 |
0.658 |
1 |
0 |
0 |
0.000 |
36 |
37 |
|
[GAL]A:1001 |
7 |
1 |
291 |
cf |
A |
x,y,z |
1_555 |
10 |
2 |
34138 |
69.4 |
2.7 |
0.403 |
1 |
0 |
0 |
0.000 |
37 |
38 |
|
[GAL]B:1001 |
7 |
1 |
292 |
cf |
B |
x,y,z |
1_555 |
11 |
2 |
34078 |
69.4 |
2.7 |
0.397 |
1 |
0 |
0 |
0.000 |
38 |
39 |
|
[EDO]A:1010 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
34078 |
68.5 |
2.1 |
0.288 |
1 |
0 |
0 |
0.000 |
39 |
40 |
|
[EDO]A:1010 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
34138 |
65.2 |
1.6 |
0.856 |
3 |
0 |
0 |
0.000 |
40 |
41 |
|
[GAL]B:1001 |
8 |
1 |
292 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
11 |
3 |
34078 |
63.1 |
0.0 |
0.141 |
1 |
0 |
0 |
0.000 |
41 |
42 |
|
[EDO]B:1011 |
3 |
1 |
185 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
7 |
3 |
34078 |
62.0 |
1.7 |
0.208 |
0 |
0 |
0 |
0.000 |
42 |
43 |
|
[EDO]A:1017 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
34138 |
60.2 |
1.5 |
0.883 |
3 |
0 |
0 |
0.000 |
43 |
44 |
|
[ZN]A:1005 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
5 |
34138 |
49.9 |
-40.1 |
0.000 |
0 |
0 |
0 |
0.152 |
45 |
|
[ZN]B:1006 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
34078 |
49.0 |
-39.1 |
0.000 |
0 |
0 |
0 |
0.152 |
Average: |
49.5 |
-39.6 |
0.000 |
0 |
0 |
0 |
0.152 |
44 |
46 |
|
A |
2 |
1 |
34138 |
f |
[EDO]A:1013 |
-x+1,y-1/2,-z |
2_645 |
4 |
1 |
185 |
38.7 |
1.1 |
0.855 |
0 |
0 |
0 |
0.000 |
45 |
47 |
|
[PO4]B:1005 |
4 |
1 |
187 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
3 |
34138 |
38.6 |
-1.3 |
0.944 |
1 |
0 |
0 |
0.000 |
46 |
48 |
|
A |
3 |
2 |
34138 |
◊ |
B |
x,y,z-1 |
1_554 |
3 |
3 |
34078 |
35.4 |
-0.1 |
0.393 |
0 |
0 |
0 |
0.000 |
47 |
49 |
|
[EDO]B:1013 |
4 |
1 |
184 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
34078 |
32.9 |
1.0 |
0.866 |
0 |
0 |
0 |
0.000 |
48 |
50 |
|
[PO4]A:1003 |
2 |
1 |
188 |
f |
[GAL]A:1001 |
x,y,z |
1_555 |
4 |
1 |
291 |
21.5 |
-1.4 |
0.312 |
0 |
0 |
0 |
0.005 |
49 |
51 |
|
[PO4]B:1004 |
1 |
1 |
188 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
4 |
3 |
34078 |
19.0 |
-0.8 |
0.796 |
0 |
0 |
0 |
0.000 |
50 |
52 |
|
A |
4 |
3 |
34138 |
◊ |
[PO4]A:1003 |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
188 |
18.5 |
-0.9 |
0.750 |
0 |
0 |
0 |
0.000 |
51 |
53 |
|
[PO4]B:1004 |
1 |
1 |
188 |
f |
[GAL]B:1001 |
x,y,z |
1_555 |
4 |
1 |
292 |
11.2 |
-0.8 |
0.282 |
0 |
0 |
0 |
0.002 |
52 |
54 |
|
B |
1 |
1 |
34078 |
f |
[EDO]B:1017 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
183 |
2.7 |
0.1 |
0.861 |
0 |
0 |
0 |
0.000 |
53 |
55 |
|
A |
1 |
1 |
34138 |
f |
[EDO]A:1012 |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
186 |
0.6 |
0.0 |
0.812 |
0 |
0 |
0 |
0.000 |
|