## |
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 |
85 |
24 |
5788 |
x |
A |
x,y,z |
1_555 |
66 |
21 |
6011 |
736.7 |
-5.8 |
0.410 |
6 |
7 |
0 |
0.692 |
2 |
|
D |
65 |
20 |
6030 |
x |
D |
-y,z-1/2,-x+1/2 |
10_545 |
82 |
23 |
6030 |
697.4 |
-7.2 |
0.241 |
6 |
5 |
0 |
0.692 |
3 |
|
C |
65 |
20 |
5809 |
x |
A |
x,y,z |
1_555 |
81 |
23 |
6011 |
666.9 |
-5.9 |
0.371 |
6 |
7 |
0 |
0.692 |
4 |
|
C |
81 |
22 |
5809 |
x |
B |
x,y,z |
1_555 |
61 |
19 |
5788 |
658.4 |
-7.0 |
0.284 |
6 |
5 |
0 |
0.692 |
Average: |
689.9 |
-6.5 |
0.327 |
6 |
6 |
0 |
0.692 |
2 |
5 |
|
D |
36 |
13 |
6030 |
◊ |
C |
z,-x,-y+1/2 |
18_555 |
26 |
7 |
5809 |
272.9 |
-1.0 |
0.571 |
2 |
0 |
0 |
0.000 |
3 |
6 |
|
B |
24 |
8 |
5788 |
◊ |
B |
-x,-y+1/2,z |
14_555 |
24 |
8 |
5788 |
245.1 |
-2.9 |
0.327 |
2 |
0 |
0 |
0.000 |
4 |
7 |
|
C |
24 |
9 |
5809 |
x |
D |
-y,z-1/2,-x+1/2 |
10_545 |
25 |
9 |
6030 |
212.9 |
-1.2 |
0.525 |
0 |
0 |
0 |
0.090 |
8 |
|
B |
23 |
9 |
5788 |
x |
B |
-y,z-1/2,-x+1/2 |
10_545 |
30 |
10 |
5788 |
210.7 |
-0.8 |
0.600 |
1 |
0 |
0 |
0.090 |
9 |
|
D |
22 |
8 |
6030 |
x |
A |
x,y,z |
1_555 |
21 |
8 |
6011 |
207.1 |
-1.4 |
0.496 |
1 |
0 |
0 |
0.090 |
10 |
|
C |
21 |
8 |
5809 |
x |
A |
-y,z-1/2,-x+1/2 |
10_545 |
21 |
8 |
6011 |
203.4 |
-1.9 |
0.417 |
0 |
0 |
0 |
0.090 |
Average: |
208.5 |
-1.3 |
0.510 |
1 |
0 |
0 |
0.090 |
5 |
11 |
|
[PE8]D:1346 |
15 |
1 |
535 |
◊ |
C |
x,y,z |
1_555 |
27 |
8 |
5809 |
197.1 |
2.7 |
0.596 |
0 |
0 |
0 |
0.000 |
12 |
|
B |
28 |
8 |
5788 |
◊ |
[PE8]A:1345 |
-y,z-1/2,-x+1/2 |
10_545 |
15 |
1 |
528 |
193.2 |
1.8 |
0.594 |
1 |
0 |
0 |
0.000 |
Average: |
195.1 |
2.3 |
0.595 |
1 |
0 |
0 |
0.000 |
6 |
13 |
|
[PE8]D:1346 |
17 |
1 |
535 |
f |
D |
x,y,z |
1_555 |
26 |
8 |
6030 |
196.6 |
-4.0 |
0.150 |
1 |
0 |
0 |
0.288 |
14 |
|
[PE8]A:1345 |
15 |
1 |
528 |
f |
A |
x,y,z |
1_555 |
28 |
8 |
6011 |
190.5 |
-2.5 |
0.245 |
1 |
0 |
0 |
0.288 |
Average: |
193.5 |
-3.2 |
0.198 |
1 |
0 |
0 |
0.288 |
7 |
15 |
|
D |
15 |
5 |
6030 |
◊ |
C |
x,-y,-z+1/2 |
16_555 |
13 |
6 |
5809 |
150.5 |
-2.2 |
0.254 |
0 |
1 |
0 |
0.000 |
8 |
16 |
|
D |
14 |
4 |
6030 |
◊ |
D |
-x+1/2,y,-z+1 |
15_556 |
14 |
4 |
6030 |
92.2 |
-0.4 |
0.579 |
0 |
0 |
0 |
0.000 |
9 |
17 |
|
B |
13 |
5 |
5788 |
◊ |
A |
-x,-y+1/2,z |
14_555 |
7 |
3 |
6011 |
92.2 |
-0.4 |
0.554 |
1 |
1 |
0 |
0.000 |
10 |
18 |
|
B |
10 |
6 |
5788 |
◊ |
A |
-y,z-1/2,-x+1/2 |
10_545 |
10 |
6 |
6011 |
91.8 |
3.7 |
0.965 |
3 |
3 |
0 |
0.000 |
19 |
|
D |
11 |
6 |
6030 |
◊ |
C |
x,y,z |
1_555 |
9 |
5 |
5809 |
82.9 |
3.2 |
0.941 |
2 |
3 |
0 |
0.000 |
Average: |
87.3 |
3.4 |
0.953 |
3 |
3 |
0 |
0.000 |
11 |
20 |
|
[PE8]A:1345 |
4 |
1 |
528 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
5788 |
60.0 |
-0.1 |
0.405 |
0 |
0 |
0 |
0.020 |
21 |
|
[PE8]D:1346 |
4 |
1 |
535 |
◊ |
D |
-y,z-1/2,-x+1/2 |
10_545 |
7 |
3 |
6030 |
59.5 |
-0.3 |
0.364 |
0 |
0 |
0 |
0.020 |
Average: |
59.7 |
-0.2 |
0.385 |
0 |
0 |
0 |
0.020 |
12 |
22 |
|
[PE8]D:1346 |
4 |
1 |
535 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
6011 |
54.0 |
1.0 |
0.508 |
0 |
0 |
0 |
0.000 |
23 |
|
C |
5 |
3 |
5809 |
◊ |
[PE8]A:1345 |
-y,z-1/2,-x+1/2 |
10_545 |
5 |
1 |
528 |
51.9 |
0.8 |
0.457 |
0 |
0 |
0 |
0.000 |
Average: |
52.9 |
0.9 |
0.483 |
0 |
0 |
0 |
0.000 |
13 |
24 |
|
[SO4]C:1346 |
4 |
1 |
185 |
f |
[SO4]C:1345 |
x,y,z |
1_555 |
4 |
1 |
187 |
52.1 |
-12.0 |
0.973 |
0 |
0 |
0 |
0.217 |
14 |
25 |
|
[SO4]C:1345 |
4 |
1 |
187 |
◊ |
D |
-y,z-1/2,-x+1/2 |
10_545 |
8 |
2 |
6030 |
47.5 |
-4.8 |
0.910 |
2 |
0 |
0 |
0.104 |
15 |
26 |
|
[SO4]C:1345 |
4 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
8 |
2 |
5809 |
46.8 |
-4.8 |
0.913 |
2 |
0 |
0 |
0.103 |
16 |
27 |
|
[SO4]C:1345 |
4 |
1 |
187 |
◊ |
A |
-y,z-1/2,-x+1/2 |
10_545 |
7 |
2 |
6011 |
46.7 |
-4.8 |
0.918 |
2 |
0 |
0 |
0.104 |
17 |
28 |
|
[SO4]C:1346 |
3 |
1 |
185 |
◊ |
D |
-y,z-1/2,-x+1/2 |
10_545 |
4 |
1 |
6030 |
38.6 |
-4.2 |
0.948 |
2 |
0 |
0 |
0.093 |
18 |
29 |
|
[SO4]C:1346 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
4 |
1 |
5809 |
38.5 |
-4.3 |
0.951 |
2 |
0 |
0 |
0.094 |
19 |
30 |
|
[SO4]C:1346 |
3 |
1 |
185 |
◊ |
A |
-y,z-1/2,-x+1/2 |
10_545 |
4 |
1 |
6011 |
37.6 |
-4.3 |
0.946 |
2 |
0 |
0 |
0.093 |
20 |
31 |
|
[SO4]B:1345 |
5 |
1 |
186 |
fx |
[SO4]B:1345 |
-y,z-1/2,-x+1/2 |
10_545 |
5 |
1 |
186 |
36.4 |
-7.6 |
0.993 |
0 |
0 |
0 |
0.148 |
21 |
32 |
|
[SO4]B:1346 |
4 |
1 |
186 |
◊ |
B |
-y,z-1/2,-x+1/2 |
10_545 |
7 |
2 |
5788 |
29.6 |
-3.7 |
0.920 |
2 |
0 |
0 |
0.089 |
22 |
33 |
|
B |
8 |
2 |
5788 |
◊ |
[SO4]B:1346 |
-y,z-1/2,-x+1/2 |
10_545 |
4 |
1 |
186 |
29.5 |
-3.7 |
0.912 |
2 |
0 |
0 |
0.089 |
23 |
34 |
|
[SO4]B:1346 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
8 |
2 |
5788 |
29.4 |
-3.7 |
0.912 |
2 |
0 |
0 |
0.089 |
24 |
35 |
|
[SO4]B:1346 |
4 |
1 |
186 |
f |
[SO4]B:1345 |
-y,z-1/2,-x+1/2 |
10_545 |
4 |
1 |
186 |
29.0 |
-6.6 |
0.973 |
0 |
0 |
0 |
0.129 |
25 |
36 |
|
[SO4]B:1346 |
4 |
1 |
186 |
f |
[SO4]B:1345 |
x,y,z |
1_555 |
4 |
1 |
186 |
28.7 |
-6.6 |
0.973 |
0 |
0 |
0 |
0.128 |
26 |
37 |
|
[SO4]B:1345 |
4 |
1 |
186 |
f |
[SO4]B:1346 |
-y,z-1/2,-x+1/2 |
10_545 |
4 |
1 |
186 |
28.6 |
-6.6 |
0.973 |
0 |
0 |
0 |
0.128 |
27 |
38 |
|
D |
5 |
2 |
6030 |
◊ |
A |
-x+1/2,y,-z+1 |
15_556 |
2 |
1 |
6011 |
22.1 |
0.1 |
0.633 |
0 |
0 |
0 |
0.000 |
28 |
39 |
|
B |
4 |
1 |
5788 |
◊ |
[SO4]B:1345 |
-y,z-1/2,-x+1/2 |
10_545 |
4 |
1 |
186 |
18.1 |
-2.0 |
0.951 |
3 |
0 |
0 |
0.064 |
29 |
40 |
|
[SO4]B:1345 |
4 |
1 |
186 |
◊ |
B |
-y,z-1/2,-x+1/2 |
10_545 |
4 |
1 |
5788 |
18.1 |
-2.0 |
0.947 |
2 |
0 |
0 |
0.057 |
30 |
41 |
|
[SO4]B:1345 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
5788 |
18.0 |
-1.9 |
0.948 |
2 |
0 |
0 |
0.055 |
31 |
42 |
|
C |
1 |
1 |
5809 |
◊ |
C |
-x+1/2,y,-z+1 |
15_556 |
1 |
1 |
5809 |
5.7 |
0.1 |
0.777 |
0 |
0 |
0 |
0.000 |
32 |
43 |
|
A |
1 |
1 |
6011 |
◊ |
A |
-x,-y+1/2,z |
14_555 |
1 |
1 |
6011 |
4.0 |
-0.1 |
0.378 |
0 |
0 |
0 |
0.000 |
|