## |
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 |
|
P |
85 |
9 |
2486 |
◊ |
A |
x,y,z |
1_555 |
94 |
35 |
26696 |
827.0 |
-14.5 |
0.228 |
17 |
0 |
0 |
0.185 |
2 |
2 |
|
A |
80 |
29 |
26696 |
x |
A |
-x-1/2,-y,z-1/2 |
2_454 |
82 |
26 |
26696 |
773.2 |
-2.5 |
0.267 |
7 |
1 |
0 |
0.000 |
3 |
3 |
|
A |
85 |
25 |
26696 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
85 |
23 |
26696 |
756.9 |
1.8 |
0.637 |
9 |
6 |
0 |
0.000 |
4 |
4 |
|
[FA2]T:6 |
18 |
1 |
440 |
f |
A |
x,y,z |
1_555 |
25 |
11 |
26696 |
181.8 |
-2.0 |
0.255 |
2 |
0 |
0 |
0.024 |
5 |
5 |
|
[TFT]T:5 |
16 |
1 |
412 |
f |
A |
x,y,z |
1_555 |
26 |
9 |
26696 |
171.2 |
-4.4 |
0.250 |
2 |
0 |
0 |
0.044 |
6 |
6 |
|
A |
19 |
6 |
26696 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
23 |
7 |
26696 |
157.7 |
-0.3 |
0.500 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
[TG]T:4 |
17 |
1 |
450 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
26696 |
130.5 |
0.7 |
0.481 |
1 |
0 |
0 |
0.000 |
8 |
8 |
|
[FA2]T:11 |
15 |
1 |
430 |
cf |
[TFT]T:12 |
x,y,z |
1_555 |
13 |
1 |
417 |
119.1 |
0.9 |
0.635 |
1 |
0 |
0 |
0.000 |
9 |
9 |
|
[TFT]T:9 |
9 |
1 |
418 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
26696 |
118.2 |
-2.5 |
0.408 |
1 |
0 |
0 |
0.025 |
10 |
10 |
|
[TC]T:15 |
13 |
1 |
409 |
cf |
[FA2]T:16 |
x,y,z |
1_555 |
13 |
1 |
433 |
117.3 |
1.7 |
0.515 |
0 |
0 |
0 |
0.000 |
11 |
11 |
|
[FA2]T:11 |
15 |
1 |
430 |
cf |
[TG]T:10 |
x,y,z |
1_555 |
16 |
1 |
455 |
116.9 |
1.2 |
0.526 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
[TG]T:10 |
10 |
1 |
455 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
26696 |
116.5 |
-0.5 |
0.499 |
4 |
0 |
0 |
0.019 |
13 |
13 |
|
[TC]T:15 |
13 |
1 |
409 |
cf |
[TG]T:14 |
x,y,z |
1_555 |
17 |
1 |
448 |
116.5 |
0.8 |
0.495 |
1 |
0 |
0 |
0.000 |
14 |
14 |
|
[TFT]T:9 |
14 |
1 |
418 |
cf |
[TG]T:8 |
x,y,z |
1_555 |
15 |
1 |
451 |
112.7 |
1.0 |
0.690 |
0 |
0 |
0 |
0.000 |
15 |
15 |
|
[TG]T:14 |
11 |
1 |
448 |
◊ |
P |
x,y,z |
1_555 |
15 |
3 |
2486 |
111.7 |
1.5 |
0.672 |
4 |
0 |
0 |
0.002 |
16 |
16 |
|
[TC]T:7 |
11 |
1 |
410 |
cf |
[FA2]T:6 |
x,y,z |
1_555 |
17 |
1 |
440 |
108.3 |
1.6 |
0.534 |
1 |
0 |
0 |
0.000 |
17 |
17 |
|
[TC]T:13 |
11 |
1 |
410 |
cf |
[TFT]T:12 |
x,y,z |
1_555 |
13 |
1 |
417 |
108.0 |
2.5 |
0.801 |
0 |
0 |
0 |
0.000 |
18 |
18 |
|
[TC]T:13 |
14 |
1 |
410 |
cf |
[TG]T:14 |
x,y,z |
1_555 |
15 |
1 |
448 |
106.8 |
1.2 |
0.539 |
1 |
0 |
0 |
0.000 |
19 |
|
[TC]T:7 |
13 |
1 |
410 |
cf |
[TG]T:8 |
x,y,z |
1_555 |
14 |
1 |
451 |
106.0 |
0.8 |
0.564 |
0 |
0 |
0 |
0.000 |
Average: |
106.4 |
1.0 |
0.551 |
1 |
0 |
0 |
0.000 |
19 |
20 |
|
[TG]T:8 |
10 |
1 |
451 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
26696 |
105.4 |
-1.4 |
0.294 |
0 |
0 |
0 |
0.012 |
20 |
21 |
|
[TFT]T:9 |
14 |
1 |
418 |
cf |
[TG]T:10 |
x,y,z |
1_555 |
13 |
1 |
455 |
102.7 |
1.3 |
0.728 |
0 |
0 |
0 |
0.000 |
21 |
22 |
|
[TG]T:8 |
10 |
1 |
451 |
◊ |
P |
x,y,z |
1_555 |
14 |
3 |
2486 |
95.4 |
1.5 |
0.702 |
3 |
0 |
0 |
0.000 |
22 |
23 |
|
[TG]T:10 |
9 |
1 |
455 |
◊ |
P |
x,y,z |
1_555 |
11 |
3 |
2486 |
89.8 |
0.8 |
0.641 |
3 |
0 |
0 |
0.004 |
23 |
24 |
|
[SO4]A:906 |
5 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
26696 |
86.3 |
-12.9 |
0.733 |
2 |
0 |
0 |
0.116 |
24 |
25 |
|
[TG]T:14 |
6 |
1 |
448 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
26696 |
83.7 |
-0.5 |
0.371 |
1 |
0 |
0 |
0.008 |
25 |
26 |
|
[TC]T:13 |
9 |
1 |
410 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
26696 |
81.6 |
-1.9 |
0.360 |
2 |
0 |
0 |
0.023 |
26 |
27 |
|
[TFT]T:5 |
9 |
1 |
412 |
cf |
[TG]T:4 |
x,y,z |
1_555 |
10 |
1 |
450 |
81.2 |
-1.1 |
0.462 |
0 |
0 |
0 |
0.009 |
27 |
28 |
|
[FA2]T:16 |
11 |
1 |
433 |
◊ |
P |
x,y,z |
1_555 |
13 |
1 |
2486 |
80.6 |
1.8 |
0.630 |
1 |
0 |
0 |
0.000 |
28 |
29 |
|
[TC]T:13 |
7 |
1 |
410 |
◊ |
P |
x,y,z |
1_555 |
10 |
3 |
2486 |
78.8 |
1.2 |
0.674 |
3 |
0 |
0 |
0.002 |
29 |
30 |
|
[FA2]T:11 |
5 |
1 |
430 |
◊ |
P |
x,y,z |
1_555 |
10 |
3 |
2486 |
78.6 |
1.1 |
0.628 |
1 |
0 |
0 |
0.000 |
30 |
31 |
|
[SO4]A:901 |
5 |
1 |
185 |
f |
A |
-x,y-1/2,-z+1/2 |
3_545 |
9 |
5 |
26696 |
78.4 |
-9.1 |
0.832 |
3 |
0 |
0 |
0.087 |
31 |
32 |
|
[SO4]A:904 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
26696 |
77.8 |
-10.4 |
0.799 |
4 |
0 |
0 |
0.102 |
32 |
33 |
|
[SO4]A:902 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
26696 |
68.8 |
-8.0 |
0.941 |
3 |
0 |
0 |
0.078 |
33 |
34 |
|
[TFT]T:12 |
7 |
1 |
417 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
26696 |
68.4 |
-1.7 |
0.420 |
0 |
0 |
0 |
0.015 |
34 |
35 |
|
[TC]T:7 |
5 |
1 |
410 |
◊ |
P |
x,y,z |
1_555 |
8 |
3 |
2486 |
66.0 |
0.4 |
0.605 |
3 |
0 |
0 |
0.008 |
35 |
36 |
|
[TC]T:7 |
7 |
1 |
410 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
26696 |
65.7 |
-1.2 |
0.401 |
0 |
0 |
0 |
0.010 |
36 |
37 |
|
[FA2]T:11 |
7 |
1 |
430 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
26696 |
63.5 |
-0.5 |
0.431 |
0 |
0 |
0 |
0.004 |
37 |
38 |
|
[FA2]T:6 |
4 |
1 |
440 |
◊ |
P |
x,y,z |
1_555 |
9 |
2 |
2486 |
62.3 |
-0.1 |
0.528 |
2 |
0 |
0 |
0.009 |
38 |
39 |
|
[SO4]P:101 |
4 |
1 |
185 |
f |
P |
x,y,z |
1_555 |
7 |
3 |
2486 |
62.1 |
-7.9 |
0.865 |
2 |
0 |
0 |
0.100 |
39 |
40 |
|
[TFT]T:12 |
5 |
1 |
417 |
◊ |
P |
x,y,z |
1_555 |
7 |
3 |
2486 |
62.1 |
-0.1 |
0.633 |
1 |
0 |
0 |
0.005 |
40 |
41 |
|
[FA2]T:6 |
7 |
1 |
440 |
cf |
[TFT]T:5 |
x,y,z |
1_555 |
9 |
1 |
412 |
60.0 |
-0.7 |
0.483 |
0 |
0 |
0 |
0.006 |
41 |
42 |
|
[TFT]T:9 |
5 |
1 |
418 |
◊ |
P |
x,y,z |
1_555 |
6 |
3 |
2486 |
58.0 |
0.4 |
0.678 |
1 |
0 |
0 |
0.000 |
42 |
43 |
|
[TC]T:15 |
4 |
1 |
409 |
◊ |
P |
x,y,z |
1_555 |
6 |
2 |
2486 |
56.3 |
-0.7 |
0.457 |
4 |
0 |
0 |
0.021 |
43 |
44 |
|
A |
6 |
1 |
26696 |
◊ |
[SO4]A:905 |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
1 |
184 |
51.0 |
-5.3 |
0.925 |
2 |
0 |
0 |
0.000 |
44 |
45 |
|
[SO4]A:905 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
26696 |
50.0 |
-5.9 |
0.914 |
1 |
0 |
0 |
0.054 |
45 |
46 |
|
[SO4]A:901 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
26696 |
49.8 |
-5.3 |
0.912 |
2 |
0 |
0 |
0.000 |
46 |
47 |
|
[SO4]A:903 |
3 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
26696 |
49.0 |
-5.4 |
0.860 |
1 |
0 |
0 |
0.049 |
47 |
48 |
|
A |
6 |
4 |
26696 |
◊ |
[SO4]A:905 |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
1 |
184 |
38.7 |
-4.6 |
0.736 |
0 |
0 |
0 |
0.000 |
48 |
49 |
|
[TC]T:7 |
3 |
1 |
410 |
f |
[TFT]T:5 |
x,y,z |
1_555 |
6 |
1 |
412 |
37.3 |
-1.4 |
0.370 |
0 |
0 |
0 |
0.012 |
49 |
50 |
|
[SO4]A:903 |
3 |
1 |
185 |
◊ |
P |
x,y,z |
1_555 |
3 |
1 |
2486 |
29.9 |
-4.3 |
0.612 |
0 |
0 |
0 |
0.036 |
50 |
51 |
|
[SO4]A:903 |
4 |
1 |
185 |
f |
[SO4]A:902 |
x,y,z |
1_555 |
4 |
1 |
185 |
22.0 |
-4.7 |
0.998 |
0 |
0 |
0 |
0.040 |
51 |
52 |
|
[TC]T:15 |
4 |
1 |
409 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
26696 |
21.4 |
-0.8 |
0.463 |
0 |
0 |
0 |
0.007 |
52 |
53 |
|
[TFT]T:9 |
1 |
1 |
418 |
◊ |
[SO4]P:101 |
x,y,z |
1_555 |
3 |
1 |
185 |
10.5 |
-1.3 |
0.605 |
0 |
0 |
0 |
0.011 |
53 |
54 |
|
[TG]T:10 |
1 |
1 |
455 |
◊ |
[SO4]P:101 |
x,y,z |
1_555 |
3 |
1 |
185 |
10.1 |
-1.1 |
0.589 |
0 |
0 |
0 |
0.009 |
54 |
55 |
|
[TG]T:8 |
1 |
1 |
451 |
◊ |
[SO4]P:101 |
x,y,z |
1_555 |
1 |
1 |
185 |
6.1 |
-0.7 |
0.529 |
0 |
0 |
0 |
0.006 |
55 |
56 |
|
[FA2]T:16 |
3 |
1 |
433 |
f |
[TG]T:14 |
x,y,z |
1_555 |
4 |
1 |
448 |
2.1 |
0.1 |
0.419 |
0 |
0 |
0 |
0.000 |
|