| ## |
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 |
634 |
145 |
22687 |
◊ |
A |
x,y,z |
1_555 |
631 |
151 |
22913 |
6135.9 |
-59.2 |
0.070 |
98 |
11 |
0 |
0.550 |
| 2 |
2 |
|
A |
97 |
30 |
22913 |
◊ |
B |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
87 |
24 |
22687 |
871.6 |
-2.1 |
0.704 |
8 |
3 |
0 |
0.000 |
| 3 |
3 |
|
[NAD]A:503 |
40 |
1 |
800 |
f |
A |
x,y,z |
1_555 |
56 |
18 |
22913 |
456.2 |
0.7 |
0.829 |
16 |
0 |
0 |
0.069 |
4 |
|
[NAD]B:2003 |
38 |
1 |
801 |
f |
B |
x,y,z |
1_555 |
55 |
18 |
22687 |
446.9 |
-0.9 |
0.778 |
13 |
0 |
0 |
0.069 |
| Average: |
451.6 |
-0.1 |
0.803 |
15 |
0 |
0 |
0.069 |
| 4 |
5 |
|
A |
48 |
13 |
22913 |
x |
A |
-y+1,x-y,z |
2_655 |
45 |
12 |
22913 |
416.8 |
-4.3 |
0.288 |
7 |
4 |
0 |
0.068 |
6 |
|
B |
48 |
13 |
22687 |
x |
B |
-y+1,x-y,z |
2_655 |
48 |
13 |
22687 |
412.0 |
-3.3 |
0.391 |
5 |
2 |
0 |
0.068 |
| Average: |
414.4 |
-3.8 |
0.339 |
6 |
3 |
0 |
0.068 |
| 5 |
7 |
|
B |
18 |
4 |
22687 |
◊ |
A |
-y+1,x-y,z |
2_655 |
19 |
4 |
22913 |
152.7 |
-0.7 |
0.586 |
0 |
0 |
0 |
0.003 |
| 6 |
8 |
|
B |
15 |
6 |
22687 |
◊ |
[NAD]B:2003 |
-y+1,x-y,z |
2_655 |
17 |
1 |
801 |
134.8 |
0.0 |
0.560 |
0 |
0 |
0 |
0.004 |
9 |
|
[NAD]A:503 |
17 |
1 |
800 |
◊ |
A |
-y+1,x-y,z |
2_655 |
17 |
6 |
22913 |
131.4 |
-0.4 |
0.535 |
1 |
0 |
0 |
0.004 |
| Average: |
133.1 |
-0.2 |
0.548 |
1 |
0 |
0 |
0.004 |
| 7 |
10 |
|
[SO4]A:501 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
22 |
11 |
22913 |
133.2 |
-18.0 |
0.807 |
5 |
0 |
0 |
0.107 |
| 8 |
11 |
|
B |
13 |
4 |
22687 |
x |
B |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
15 |
7 |
22687 |
127.4 |
1.0 |
0.787 |
1 |
1 |
0 |
0.000 |
12 |
|
A |
11 |
6 |
22913 |
x |
A |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
8 |
2 |
22913 |
59.5 |
0.2 |
0.680 |
1 |
1 |
0 |
0.000 |
| Average: |
93.5 |
0.6 |
0.734 |
1 |
1 |
0 |
0.000 |
| 9 |
13 |
|
[SO4]B:2002 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
16 |
10 |
22687 |
115.2 |
-16.5 |
0.757 |
5 |
0 |
0 |
0.099 |
| 10 |
14 |
|
[SO4]B:2001 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
13 |
3 |
22913 |
69.0 |
-9.3 |
0.697 |
1 |
0 |
0 |
0.051 |
| 11 |
15 |
|
[SO4]A:502 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
13 |
3 |
22687 |
61.1 |
-8.1 |
0.700 |
1 |
0 |
0 |
0.045 |
| 12 |
16 |
|
[SO4]A:502 |
5 |
1 |
188 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
22913 |
49.7 |
-6.9 |
0.683 |
0 |
0 |
0 |
0.036 |
| 13 |
17 |
|
[SO4]B:2001 |
5 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
22687 |
49.3 |
-6.2 |
0.817 |
0 |
0 |
0 |
0.033 |
| 14 |
18 |
|
[SO4]A:501 |
3 |
1 |
189 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
22687 |
21.3 |
-1.9 |
0.976 |
0 |
0 |
0 |
0.010 |
| 15 |
19 |
|
A |
1 |
1 |
22913 |
◊ |
B |
-y+1,x-y,z |
2_655 |
2 |
1 |
22687 |
7.4 |
0.5 |
0.870 |
0 |
0 |
0 |
0.000 |
| 16 |
20 |
|
B |
1 |
1 |
22687 |
◊ |
A |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
2 |
1 |
22913 |
3.1 |
0.0 |
0.536 |
0 |
0 |
0 |
0.000 |
|