| ## |
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 |
|
D |
209 |
55 |
23634 |
◊ |
C |
x,y,z |
1_555 |
208 |
53 |
23909 |
1963.9 |
-10.8 |
0.310 |
28 |
6 |
0 |
0.284 |
2 |
|
B |
205 |
55 |
24182 |
◊ |
A |
x,y,z |
1_555 |
212 |
54 |
24436 |
1918.8 |
-12.5 |
0.290 |
28 |
4 |
0 |
0.284 |
| Average: |
1941.3 |
-11.7 |
0.300 |
28 |
5 |
0 |
0.284 |
| 2 |
3 |
|
C |
105 |
32 |
23909 |
◊ |
A |
x,y,z |
1_555 |
108 |
32 |
24436 |
1024.4 |
3.0 |
0.844 |
11 |
4 |
0 |
0.000 |
4 |
|
D |
107 |
32 |
23634 |
◊ |
B |
x,y,z |
1_555 |
100 |
32 |
24182 |
958.7 |
4.1 |
0.872 |
8 |
3 |
0 |
0.000 |
| Average: |
991.6 |
3.5 |
0.858 |
10 |
4 |
0 |
0.000 |
| 3 |
5 |
|
B |
81 |
22 |
24182 |
◊ |
A |
x-1,y,z |
1_455 |
92 |
31 |
24436 |
841.2 |
-8.8 |
0.144 |
5 |
2 |
0 |
0.016 |
| 4 |
6 |
|
D |
75 |
20 |
23634 |
◊ |
A |
x,y,z |
1_555 |
70 |
22 |
24436 |
665.0 |
2.8 |
0.831 |
6 |
10 |
0 |
0.000 |
7 |
|
C |
75 |
21 |
23909 |
◊ |
B |
x,y,z |
1_555 |
73 |
21 |
24182 |
656.5 |
2.3 |
0.804 |
8 |
5 |
0 |
0.000 |
| Average: |
660.8 |
2.5 |
0.818 |
7 |
8 |
0 |
0.000 |
| 5 |
8 |
|
C |
45 |
13 |
23909 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
38 |
16 |
24182 |
379.5 |
0.7 |
0.564 |
4 |
0 |
0 |
0.000 |
| 6 |
9 |
|
C |
33 |
13 |
23909 |
◊ |
D |
x,y,z-1 |
1_554 |
42 |
14 |
23634 |
334.6 |
-1.1 |
0.522 |
2 |
0 |
0 |
0.000 |
| 7 |
10 |
|
B |
31 |
10 |
24182 |
◊ |
C |
x-1,y,z |
1_455 |
43 |
13 |
23909 |
305.0 |
-2.2 |
0.353 |
1 |
3 |
0 |
0.000 |
| 8 |
11 |
|
C |
30 |
12 |
23909 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
35 |
12 |
24436 |
294.0 |
-1.5 |
0.190 |
1 |
0 |
0 |
0.000 |
12 |
|
C |
33 |
12 |
23909 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
23 |
10 |
24436 |
265.5 |
-1.8 |
0.183 |
1 |
0 |
0 |
0.000 |
| Average: |
279.8 |
-1.7 |
0.186 |
1 |
0 |
0 |
0.000 |
| 9 |
13 |
|
[1CY]B:602 |
15 |
1 |
415 |
f |
B |
x,y,z |
1_555 |
39 |
17 |
24182 |
292.3 |
-5.1 |
0.468 |
5 |
0 |
0 |
0.183 |
14 |
|
[1CY]C:603 |
14 |
1 |
413 |
f |
C |
x,y,z |
1_555 |
39 |
18 |
23909 |
289.3 |
-5.8 |
0.330 |
5 |
0 |
0 |
0.183 |
15 |
|
[1CY]D:604 |
14 |
1 |
417 |
f |
D |
x,y,z |
1_555 |
36 |
17 |
23634 |
284.1 |
-5.4 |
0.324 |
5 |
0 |
0 |
0.183 |
16 |
|
[1CY]A:601 |
14 |
1 |
417 |
f |
A |
x,y,z |
1_555 |
36 |
16 |
24436 |
266.8 |
-5.4 |
0.308 |
5 |
0 |
0 |
0.183 |
| Average: |
283.1 |
-5.4 |
0.358 |
5 |
0 |
0 |
0.183 |
| 10 |
17 |
|
A |
26 |
6 |
24436 |
◊ |
D |
x,y,z-1 |
1_554 |
28 |
10 |
23634 |
276.7 |
-4.5 |
0.120 |
0 |
1 |
0 |
0.000 |
| 11 |
18 |
|
D |
30 |
14 |
23634 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
24 |
11 |
24436 |
211.0 |
2.3 |
0.761 |
0 |
0 |
0 |
0.000 |
| 12 |
19 |
|
C |
29 |
9 |
23909 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
21 |
7 |
23634 |
163.9 |
1.9 |
0.811 |
1 |
0 |
0 |
0.000 |
| 13 |
20 |
|
D |
12 |
4 |
23634 |
◊ |
A |
x-1,y,z |
1_455 |
17 |
6 |
24436 |
162.8 |
2.2 |
0.865 |
5 |
6 |
0 |
0.000 |
| 14 |
21 |
|
[ACT]B:805 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
18 |
10 |
24182 |
121.3 |
-0.9 |
0.520 |
2 |
0 |
0 |
0.020 |
| 15 |
22 |
|
[ACT]C:807 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
16 |
8 |
23909 |
117.9 |
-1.0 |
0.523 |
4 |
0 |
0 |
0.032 |
| 16 |
23 |
|
[ACT]A:802 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
15 |
9 |
24436 |
114.1 |
-1.0 |
0.528 |
1 |
0 |
0 |
0.015 |
| 17 |
24 |
|
[ACT]D:808 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
17 |
9 |
23634 |
111.8 |
-0.9 |
0.559 |
4 |
0 |
0 |
0.031 |
| 18 |
25 |
|
[ACT]B:804 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
15 |
9 |
24182 |
110.0 |
-0.9 |
0.516 |
4 |
0 |
0 |
0.030 |
| 19 |
26 |
|
[ACT]A:803 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
24436 |
105.2 |
-0.2 |
0.636 |
1 |
0 |
0 |
0.007 |
| 20 |
27 |
|
[PO4]A:705 |
5 |
1 |
193 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
24436 |
104.8 |
-6.6 |
0.715 |
7 |
0 |
0 |
0.106 |
28 |
|
[PO4]C:707 |
5 |
1 |
193 |
f |
C |
x,y,z |
1_555 |
15 |
6 |
23909 |
103.0 |
-6.4 |
0.734 |
6 |
0 |
0 |
0.106 |
| Average: |
103.9 |
-6.5 |
0.724 |
7 |
0 |
0 |
0.106 |
| 21 |
29 |
|
[ACT]A:801 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
24436 |
100.7 |
-1.3 |
0.416 |
4 |
0 |
0 |
0.033 |
| 22 |
30 |
|
[PO4]D:708 |
5 |
1 |
193 |
f |
D |
x,y,z |
1_555 |
14 |
6 |
23634 |
100.5 |
-6.7 |
0.701 |
4 |
0 |
0 |
0.099 |
| 23 |
31 |
|
[PO4]B:706 |
5 |
1 |
192 |
f |
B |
x,y,z |
1_555 |
16 |
6 |
24182 |
99.8 |
-5.9 |
0.808 |
6 |
0 |
0 |
0.094 |
| 24 |
32 |
|
[PO4]B:702 |
5 |
1 |
193 |
f |
A |
x,y,z |
1_555 |
11 |
2 |
24436 |
86.9 |
-3.7 |
0.891 |
5 |
0 |
0 |
0.065 |
| 25 |
33 |
|
B |
6 |
3 |
24182 |
◊ |
[1CY]A:601 |
x-1,y,z |
1_455 |
9 |
1 |
417 |
83.3 |
-2.9 |
0.117 |
0 |
0 |
0 |
0.004 |
| 26 |
34 |
|
[PO4]C:703 |
5 |
1 |
194 |
◊ |
D |
x,y,z |
1_555 |
11 |
2 |
23634 |
83.2 |
-4.3 |
0.807 |
3 |
0 |
0 |
0.066 |
| 27 |
35 |
|
[PO4]B:702 |
5 |
1 |
193 |
◊ |
B |
x,y,z |
1_555 |
13 |
8 |
24182 |
82.0 |
-4.7 |
0.831 |
2 |
0 |
0 |
0.061 |
| 28 |
36 |
|
[PO4]A:701 |
5 |
1 |
193 |
◊ |
B |
x,y,z |
1_555 |
9 |
2 |
24182 |
81.0 |
-4.1 |
0.818 |
3 |
0 |
0 |
0.059 |
| 29 |
37 |
|
[PO4]A:701 |
5 |
1 |
193 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
24436 |
80.5 |
-4.5 |
0.843 |
2 |
0 |
0 |
0.059 |
| 30 |
38 |
|
[PO4]D:704 |
5 |
1 |
192 |
◊ |
C |
x,y,z |
1_555 |
11 |
2 |
23909 |
75.9 |
-3.8 |
0.808 |
2 |
0 |
0 |
0.055 |
| 31 |
39 |
|
[PO4]C:703 |
4 |
1 |
194 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
23909 |
73.9 |
-4.4 |
0.767 |
3 |
0 |
0 |
0.067 |
| 32 |
40 |
|
[ACT]B:806 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
23634 |
73.8 |
-1.4 |
0.422 |
0 |
0 |
0 |
0.017 |
| 33 |
41 |
|
[PO4]D:704 |
4 |
1 |
192 |
f |
D |
x,y,z |
1_555 |
9 |
7 |
23634 |
71.7 |
-4.2 |
0.769 |
2 |
0 |
0 |
0.060 |
| 34 |
42 |
|
[ACT]B:806 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
9 |
5 |
24182 |
68.1 |
-0.1 |
0.603 |
1 |
0 |
0 |
0.000 |
| 35 |
43 |
|
B |
7 |
3 |
24182 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
13 |
4 |
24436 |
60.7 |
1.1 |
0.768 |
0 |
0 |
0 |
0.000 |
| 36 |
44 |
|
B |
8 |
3 |
24182 |
◊ |
D |
x-1,y,z-1 |
1_454 |
9 |
5 |
23634 |
47.9 |
0.9 |
0.782 |
0 |
0 |
0 |
0.000 |
| 37 |
45 |
|
C |
5 |
2 |
23909 |
◊ |
A |
x-1,y,z-1 |
1_454 |
6 |
3 |
24436 |
43.4 |
0.2 |
0.669 |
1 |
1 |
0 |
0.000 |
| 38 |
46 |
|
[ACT]A:803 |
4 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
23909 |
39.8 |
0.3 |
0.716 |
0 |
0 |
0 |
0.000 |
| 39 |
47 |
|
[ACT]A:802 |
4 |
1 |
183 |
f |
[ACT]A:801 |
x,y,z |
1_555 |
4 |
1 |
184 |
39.2 |
-0.7 |
0.662 |
0 |
0 |
0 |
0.007 |
| 40 |
48 |
|
[ACT]A:801 |
1 |
1 |
184 |
f |
[PO4]A:705 |
x,y,z |
1_555 |
1 |
1 |
193 |
5.8 |
-0.3 |
0.632 |
0 |
0 |
0 |
0.003 |
| 41 |
49 |
|
D |
2 |
1 |
23634 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
2 |
2 |
24182 |
2.7 |
-0.0 |
0.578 |
0 |
0 |
0 |
0.000 |
| 42 |
50 |
|
[ACT]B:804 |
1 |
1 |
183 |
f |
[PO4]B:706 |
x,y,z |
1_555 |
1 |
1 |
192 |
0.4 |
-0.0 |
0.632 |
0 |
0 |
0 |
0.000 |
|