| ## |
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 |
70 |
21 |
10094 |
◊ |
B |
y+1,x-1,-z |
4_645 |
70 |
21 |
10094 |
665.7 |
-3.6 |
0.303 |
8 |
0 |
0 |
0.027 |
| 2 |
2 |
|
A |
78 |
20 |
9641 |
x |
A |
-x+1,-x+y,-z+1/3 |
6_655 |
72 |
17 |
9641 |
584.9 |
-0.7 |
0.486 |
5 |
2 |
0 |
0.000 |
| 3 |
3 |
|
B |
55 |
16 |
10094 |
◊ |
A |
x,y,z |
1_555 |
54 |
15 |
9641 |
546.0 |
-4.2 |
0.234 |
9 |
0 |
0 |
0.003 |
| 4 |
4 |
|
A |
41 |
13 |
9641 |
◊ |
B |
-y+1,x-y,z+1/3 |
2_655 |
46 |
10 |
10094 |
422.0 |
0.3 |
0.569 |
8 |
0 |
0 |
0.000 |
| 5 |
5 |
|
A |
18 |
5 |
9641 |
◊ |
B |
y,x-1,-z |
4_545 |
15 |
6 |
10094 |
127.9 |
0.6 |
0.569 |
1 |
0 |
0 |
0.000 |
| 6 |
6 |
|
B |
15 |
7 |
10094 |
◊ |
A |
-x+2,-x+y+1,-z+1/3 |
6_765 |
11 |
3 |
9641 |
114.8 |
0.7 |
0.547 |
1 |
1 |
0 |
0.000 |
| 7 |
7 |
|
B |
12 |
5 |
10094 |
x |
B |
y,x-1,-z |
4_545 |
17 |
7 |
10094 |
114.7 |
0.1 |
0.546 |
1 |
0 |
0 |
0.000 |
| 8 |
8 |
|
A |
12 |
4 |
9641 |
◊ |
A |
-x+2,-x+y+1,-z+1/3 |
6_765 |
12 |
4 |
9641 |
113.1 |
2.0 |
0.826 |
4 |
0 |
0 |
0.000 |
| 9 |
9 |
|
[GOL]B:1303 |
6 |
1 |
208 |
◊ |
B |
-y+1,x-y,z+1/3 |
2_655 |
17 |
7 |
10094 |
109.5 |
1.2 |
0.687 |
2 |
0 |
0 |
0.000 |
| 10 |
10 |
|
[GOL]B:1296 |
6 |
1 |
206 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
10094 |
102.9 |
0.3 |
0.592 |
2 |
0 |
0 |
0.005 |
| 11 |
11 |
|
[SO4]A:1298 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
9641 |
102.5 |
-16.6 |
0.595 |
6 |
0 |
0 |
0.017 |
| 12 |
12 |
|
[SO4]B:1300 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
10094 |
102.4 |
-16.5 |
0.563 |
5 |
0 |
0 |
0.143 |
| 13 |
13 |
|
[GOL]B:1293 |
6 |
1 |
208 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
10094 |
94.6 |
-0.1 |
0.548 |
2 |
0 |
0 |
0.008 |
| 14 |
14 |
|
B |
12 |
5 |
10094 |
◊ |
[GOL]A:1292 |
y,x-1,-z |
4_545 |
6 |
1 |
209 |
88.8 |
1.0 |
0.667 |
3 |
0 |
0 |
0.000 |
| 15 |
15 |
|
[GOL]A:1295 |
6 |
1 |
208 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
9641 |
87.9 |
-0.6 |
0.482 |
1 |
0 |
0 |
0.000 |
| 16 |
16 |
|
[AZI]B:1295 |
3 |
1 |
159 |
f |
B |
x,y,z |
1_555 |
13 |
8 |
10094 |
87.2 |
0.7 |
0.481 |
0 |
0 |
0 |
0.000 |
| 17 |
17 |
|
[GOL]B:1292 |
6 |
1 |
206 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
10094 |
82.2 |
-0.8 |
0.430 |
4 |
0 |
0 |
0.019 |
| 18 |
18 |
|
[GOL]B:1297 |
6 |
1 |
203 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
10094 |
81.8 |
-0.2 |
0.541 |
2 |
0 |
0 |
0.008 |
| 19 |
19 |
|
[GOL]A:1294 |
5 |
1 |
205 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
9641 |
80.8 |
0.7 |
0.624 |
1 |
0 |
0 |
0.000 |
| 20 |
20 |
|
A |
9 |
4 |
9641 |
f |
[SO4]A:1299 |
-x+1,-x+y,-z+1/3 |
6_655 |
5 |
1 |
186 |
74.2 |
-10.5 |
0.809 |
2 |
0 |
0 |
0.010 |
| 21 |
21 |
|
[SO4]B:1302 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
10094 |
71.3 |
-9.5 |
0.677 |
1 |
0 |
0 |
0.076 |
| 22 |
22 |
|
[SO4]A:1299 |
5 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
9641 |
68.6 |
-9.8 |
0.861 |
2 |
0 |
0 |
0.000 |
| 23 |
23 |
|
[GOL]B:1294 |
6 |
1 |
205 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
10094 |
67.6 |
-0.1 |
0.534 |
1 |
0 |
0 |
0.004 |
| 24 |
24 |
|
[GOL]A:1293 |
5 |
1 |
206 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
9641 |
63.0 |
-0.0 |
0.541 |
0 |
0 |
0 |
0.000 |
| 25 |
25 |
|
[SO4]B:1301 |
5 |
1 |
185 |
f |
B |
y+1,x-1,-z |
4_645 |
4 |
2 |
10094 |
57.3 |
-6.9 |
0.935 |
2 |
0 |
0 |
0.059 |
| 26 |
26 |
|
[SO4]B:1301 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
10094 |
55.0 |
-6.5 |
0.897 |
2 |
0 |
0 |
0.056 |
| 27 |
27 |
|
[ZN]A:1297 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
9641 |
52.7 |
-34.3 |
0.000 |
0 |
0 |
0 |
0.031 |
| 28 |
28 |
|
[GOL]A:1292 |
5 |
1 |
209 |
f |
A |
x,y,z |
1_555 |
7 |
1 |
9641 |
51.0 |
-0.7 |
0.372 |
0 |
0 |
0 |
0.000 |
| 29 |
29 |
|
[ZN]A:1296 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
9641 |
46.5 |
-35.6 |
0.000 |
0 |
0 |
0 |
0.441 |
30 |
|
[ZN]B:1298 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
10094 |
42.5 |
-32.2 |
0.000 |
0 |
0 |
0 |
0.441 |
31 |
|
[ZN]B:1299 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
10094 |
41.3 |
-25.6 |
0.000 |
0 |
0 |
0 |
0.441 |
| Average: |
43.4 |
-31.2 |
0.000 |
0 |
0 |
0 |
0.441 |
| 30 |
32 |
|
[GOL]B:1296 |
5 |
1 |
206 |
f |
[GOL]B:1294 |
x,y,z |
1_555 |
3 |
1 |
205 |
38.2 |
-0.1 |
0.511 |
0 |
0 |
0 |
0.000 |
| 31 |
33 |
|
[AZI]B:1295 |
2 |
1 |
159 |
f |
[ZN]B:1299 |
x,y,z |
1_555 |
1 |
1 |
98 |
24.7 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.072 |
| 32 |
34 |
|
B |
4 |
3 |
10094 |
◊ |
A |
y,x-1,-z |
4_545 |
3 |
2 |
9641 |
23.7 |
0.4 |
0.697 |
0 |
0 |
0 |
0.000 |
| 33 |
35 |
|
A |
2 |
1 |
9641 |
◊ |
[SO4]B:1302 |
y,x-1,-z |
4_545 |
2 |
1 |
187 |
15.7 |
-2.0 |
0.739 |
0 |
0 |
0 |
0.000 |
| 34 |
36 |
|
A |
2 |
1 |
9641 |
◊ |
[SO4]B:1301 |
x-1,y,z |
1_455 |
4 |
1 |
185 |
14.7 |
-1.7 |
0.511 |
0 |
0 |
0 |
0.000 |
| 35 |
37 |
|
[SO4]A:1298 |
1 |
1 |
186 |
◊ |
A |
-x+1,-x+y,-z+1/3 |
6_655 |
1 |
1 |
9641 |
13.8 |
-1.2 |
0.874 |
0 |
0 |
0 |
0.000 |
| 36 |
38 |
|
[GOL]B:1303 |
2 |
1 |
208 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
9641 |
13.4 |
-0.2 |
0.419 |
0 |
0 |
0 |
0.000 |
| 37 |
39 |
|
[ZN]A:1297 |
1 |
1 |
98 |
f |
[ZN]A:1296 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.4 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.008 |
| 38 |
40 |
|
[ZN]B:1299 |
1 |
1 |
98 |
f |
[ZN]B:1298 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.2 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.062 |
| 39 |
41 |
|
[AZI]B:1295 |
3 |
1 |
159 |
f |
[ZN]B:1298 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.5 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.024 |
| 40 |
42 |
|
[GOL]B:1292 |
2 |
1 |
206 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
9641 |
6.2 |
-0.1 |
0.597 |
0 |
0 |
0 |
0.000 |
| 41 |
43 |
|
[AZI]B:1295 |
1 |
1 |
159 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
9641 |
3.4 |
0.1 |
0.514 |
0 |
0 |
0 |
0.000 |
| 42 |
44 |
|
[SO4]A:1298 |
1 |
1 |
186 |
f |
[GOL]A:1295 |
x,y,z |
1_555 |
1 |
1 |
208 |
0.9 |
-0.1 |
0.707 |
0 |
0 |
0 |
0.000 |
|