## |
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 |
149 |
36 |
20179 |
◊ |
A |
x,y,z |
1_555 |
151 |
36 |
20009 |
1321.9 |
-11.0 |
0.264 |
23 |
4 |
0 |
0.186 |
2 |
2 |
|
B |
62 |
18 |
20179 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
66 |
20 |
20009 |
567.4 |
4.0 |
0.950 |
9 |
3 |
0 |
0.000 |
3 |
3 |
|
A |
28 |
8 |
20009 |
x |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
26 |
9 |
20009 |
275.0 |
-3.1 |
0.255 |
1 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
31 |
10 |
20009 |
◊ |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
31 |
11 |
20179 |
274.1 |
-0.8 |
0.574 |
3 |
1 |
0 |
0.000 |
5 |
5 |
|
B |
26 |
9 |
20179 |
x |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
27 |
8 |
20179 |
238.6 |
-2.5 |
0.277 |
3 |
0 |
0 |
0.000 |
6 |
6 |
|
[CHQ]B:1512 |
17 |
1 |
385 |
f |
B |
x,y,z |
1_555 |
43 |
16 |
20179 |
233.1 |
-0.3 |
0.431 |
3 |
0 |
0 |
0.027 |
7 |
|
[CHQ]A:1513 |
17 |
1 |
377 |
f |
A |
x,y,z |
1_555 |
41 |
16 |
20009 |
228.2 |
-0.2 |
0.488 |
3 |
0 |
0 |
0.027 |
Average: |
230.7 |
-0.2 |
0.460 |
3 |
0 |
0 |
0.027 |
7 |
8 |
|
[CHQ]A:1514 |
17 |
1 |
395 |
f |
A |
x,y,z |
1_555 |
31 |
8 |
20009 |
224.9 |
-1.0 |
0.409 |
0 |
0 |
0 |
0.009 |
8 |
9 |
|
[CHQ]B:1513 |
17 |
1 |
398 |
f |
B |
x,y,z |
1_555 |
32 |
7 |
20179 |
218.1 |
-1.2 |
0.378 |
0 |
0 |
0 |
0.010 |
9 |
10 |
|
B |
15 |
8 |
20179 |
x |
B |
x-1,y,z |
1_455 |
22 |
7 |
20179 |
195.0 |
-1.8 |
0.344 |
1 |
0 |
0 |
0.000 |
10 |
11 |
|
[GOL]A:1502 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
20009 |
137.8 |
-0.1 |
0.620 |
2 |
0 |
0 |
0.009 |
11 |
12 |
|
[GOL]A:1507 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
24 |
11 |
20009 |
137.0 |
-0.1 |
0.629 |
3 |
0 |
0 |
0.013 |
12 |
13 |
|
[GOL]B:1503 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
20179 |
134.3 |
-0.8 |
0.498 |
5 |
0 |
0 |
0.025 |
13 |
14 |
|
[GOL]A:1501 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
22 |
8 |
20009 |
133.7 |
-0.8 |
0.516 |
5 |
0 |
0 |
0.025 |
14 |
15 |
|
A |
15 |
4 |
20009 |
x |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
15 |
6 |
20009 |
132.8 |
-1.2 |
0.377 |
0 |
0 |
0 |
0.000 |
15 |
16 |
|
A |
17 |
7 |
20009 |
x |
A |
x-1,y,z |
1_455 |
13 |
5 |
20009 |
132.4 |
-0.3 |
0.602 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[GOL]B:1501 |
6 |
1 |
214 |
f |
B |
x,y,z |
1_555 |
16 |
9 |
20179 |
127.2 |
-1.0 |
0.498 |
1 |
0 |
0 |
0.013 |
17 |
18 |
|
[GOL]A:1509 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
23 |
9 |
20009 |
126.1 |
-0.6 |
0.507 |
3 |
0 |
0 |
0.016 |
18 |
19 |
|
[GOL]A:1503 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
20009 |
117.3 |
-0.4 |
0.588 |
3 |
0 |
0 |
0.015 |
19 |
20 |
|
[GOL]A:1510 |
6 |
1 |
215 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
20009 |
116.2 |
-0.7 |
0.568 |
3 |
0 |
0 |
0.017 |
20 |
21 |
|
[GOL]B:1502 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
20179 |
114.5 |
-0.0 |
0.594 |
3 |
0 |
0 |
0.012 |
21 |
22 |
|
[GOL]A:1508 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
20009 |
107.6 |
-0.2 |
0.525 |
4 |
0 |
0 |
0.017 |
22 |
23 |
|
[GOL]B:1507 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
18 |
7 |
20179 |
106.5 |
0.4 |
0.654 |
5 |
0 |
0 |
0.016 |
23 |
24 |
|
[GOL]B:1505 |
5 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
20179 |
101.6 |
0.1 |
0.594 |
2 |
0 |
0 |
0.007 |
24 |
25 |
|
[SO4]B:1511 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
20179 |
93.5 |
-12.1 |
0.821 |
2 |
0 |
0 |
0.111 |
25 |
26 |
|
[GOL]B:1504 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
20179 |
89.9 |
0.0 |
0.598 |
1 |
0 |
0 |
0.004 |
26 |
27 |
|
[GOL]A:1504 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
20009 |
88.6 |
0.7 |
0.717 |
4 |
0 |
0 |
0.009 |
27 |
28 |
|
[GOL]B:1500 |
5 |
1 |
220 |
◊ |
B |
x,y,z |
1_555 |
16 |
5 |
20179 |
88.0 |
-0.5 |
0.498 |
0 |
0 |
0 |
0.004 |
28 |
29 |
|
[GOL]B:1506 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
14 |
4 |
20179 |
85.2 |
-1.0 |
0.418 |
0 |
0 |
0 |
0.015 |
30 |
|
[GOL]A:1500 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
14 |
4 |
20009 |
77.2 |
-0.8 |
0.415 |
0 |
0 |
0 |
0.015 |
Average: |
81.2 |
-0.9 |
0.417 |
0 |
0 |
0 |
0.015 |
29 |
31 |
|
[GOL]A:1505 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
17 |
5 |
20009 |
84.1 |
-0.1 |
0.565 |
3 |
0 |
0 |
0.012 |
30 |
32 |
|
[GOL]A:1505 |
5 |
1 |
221 |
◊ |
B |
x,y,z |
1_555 |
16 |
9 |
20179 |
83.4 |
0.1 |
0.594 |
2 |
0 |
0 |
0.006 |
31 |
33 |
|
[GOL]B:1500 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
20009 |
82.0 |
0.5 |
0.707 |
3 |
0 |
0 |
0.007 |
32 |
34 |
|
B |
10 |
4 |
20179 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
9 |
2 |
20009 |
78.1 |
-0.4 |
0.526 |
1 |
0 |
0 |
0.000 |
33 |
35 |
|
[GOL]B:1506 |
6 |
1 |
220 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
20009 |
72.7 |
-0.1 |
0.528 |
2 |
0 |
0 |
0.014 |
36 |
|
[GOL]A:1500 |
6 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
20179 |
65.1 |
-0.2 |
0.485 |
1 |
0 |
0 |
0.014 |
Average: |
68.9 |
-0.1 |
0.506 |
2 |
0 |
0 |
0.014 |
34 |
37 |
|
B |
4 |
2 |
20179 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
10 |
3 |
20009 |
71.3 |
-1.1 |
0.179 |
0 |
0 |
0 |
0.000 |
35 |
38 |
|
[SO4]A:1511 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
20009 |
68.9 |
-8.1 |
0.952 |
2 |
0 |
0 |
0.076 |
36 |
39 |
|
[SO4]B:1508 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
20179 |
64.4 |
-7.7 |
0.913 |
2 |
0 |
0 |
0.073 |
37 |
40 |
|
[GOL]A:1506 |
5 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
20009 |
62.8 |
0.0 |
0.572 |
0 |
0 |
0 |
0.000 |
38 |
41 |
|
[SO4]B:1509 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
20179 |
60.8 |
-8.4 |
0.690 |
1 |
0 |
0 |
0.076 |
39 |
42 |
|
[SO4]A:1512 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
20009 |
59.3 |
-8.1 |
0.702 |
1 |
0 |
0 |
0.073 |
40 |
43 |
|
[CHQ]B:1513 |
7 |
1 |
398 |
f |
[CHQ]B:1512 |
x,y,z |
1_555 |
8 |
1 |
385 |
58.3 |
-1.0 |
0.246 |
0 |
0 |
0 |
0.008 |
41 |
44 |
|
[SO4]B:1510 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
20179 |
53.5 |
-7.6 |
0.636 |
1 |
0 |
0 |
0.068 |
42 |
45 |
|
[CHQ]A:1514 |
6 |
1 |
395 |
f |
[CHQ]A:1513 |
x,y,z |
1_555 |
7 |
1 |
377 |
51.7 |
-1.0 |
0.248 |
0 |
0 |
0 |
0.009 |
43 |
46 |
|
[SO4]B:1508 |
4 |
1 |
187 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
5 |
3 |
20009 |
45.8 |
-4.5 |
0.964 |
1 |
0 |
0 |
0.000 |
44 |
47 |
|
B |
8 |
5 |
20179 |
◊ |
[SO4]A:1511 |
-x+3/2,-y+1,z-1/2 |
2_664 |
4 |
1 |
186 |
45.1 |
-4.9 |
0.932 |
1 |
0 |
0 |
0.000 |
45 |
48 |
|
B |
5 |
2 |
20179 |
◊ |
[GOL]B:1502 |
x-1,y,z |
1_455 |
5 |
1 |
219 |
42.9 |
-0.9 |
0.370 |
0 |
0 |
0 |
0.000 |
46 |
49 |
|
[CHQ]B:1513 |
5 |
1 |
398 |
f |
[GOL]B:1507 |
x,y,z |
1_555 |
4 |
1 |
220 |
41.3 |
-0.4 |
0.402 |
0 |
0 |
0 |
0.003 |
47 |
50 |
|
[GOL]A:1503 |
4 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
8 |
1 |
20179 |
41.1 |
-0.6 |
0.430 |
0 |
0 |
0 |
0.006 |
48 |
51 |
|
[GOL]A:1506 |
4 |
1 |
219 |
f |
A |
x-1,y,z |
1_455 |
3 |
1 |
20009 |
39.9 |
0.3 |
0.662 |
1 |
0 |
0 |
0.001 |
49 |
52 |
|
[CHQ]B:1512 |
5 |
1 |
385 |
f |
[GOL]B:1507 |
x,y,z |
1_555 |
4 |
1 |
220 |
39.7 |
-0.0 |
0.388 |
0 |
0 |
0 |
0.000 |
50 |
53 |
|
[GOL]A:1504 |
3 |
1 |
219 |
◊ |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
4 |
3 |
20009 |
39.6 |
-1.0 |
0.252 |
0 |
0 |
0 |
0.000 |
51 |
54 |
|
[CHQ]A:1513 |
5 |
1 |
377 |
f |
[GOL]A:1508 |
x,y,z |
1_555 |
5 |
1 |
221 |
39.5 |
-0.4 |
0.362 |
0 |
0 |
0 |
0.003 |
52 |
55 |
|
[GOL]B:1504 |
3 |
1 |
218 |
f |
[GOL]B:1501 |
x,y,z |
1_555 |
4 |
1 |
214 |
34.9 |
0.5 |
0.644 |
1 |
0 |
0 |
0.000 |
53 |
56 |
|
[CHQ]A:1514 |
4 |
1 |
395 |
f |
[GOL]A:1508 |
x,y,z |
1_555 |
4 |
1 |
221 |
34.4 |
0.3 |
0.518 |
0 |
0 |
0 |
0.000 |
54 |
57 |
|
[CHQ]A:1514 |
3 |
1 |
395 |
f |
[GOL]A:1509 |
x,y,z |
1_555 |
4 |
1 |
219 |
34.4 |
0.5 |
0.529 |
0 |
0 |
0 |
0.000 |
55 |
58 |
|
[CHQ]A:1514 |
2 |
1 |
395 |
◊ |
B |
x,y,z |
1_555 |
7 |
1 |
20179 |
32.9 |
-0.4 |
0.388 |
0 |
0 |
0 |
0.004 |
56 |
59 |
|
[GOL]A:1509 |
3 |
1 |
219 |
f |
[GOL]A:1500 |
x,y,z |
1_555 |
5 |
1 |
219 |
32.0 |
-0.6 |
0.438 |
0 |
0 |
0 |
0.005 |
57 |
60 |
|
[SO4]B:1510 |
3 |
1 |
186 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
1 |
20009 |
30.9 |
-3.0 |
0.941 |
0 |
0 |
0 |
0.000 |
58 |
61 |
|
[SO4]B:1510 |
3 |
1 |
186 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
3 |
20179 |
29.1 |
-3.3 |
0.887 |
0 |
0 |
0 |
0.000 |
59 |
62 |
|
[CHQ]B:1513 |
2 |
1 |
398 |
◊ |
A |
x,y,z |
1_555 |
7 |
1 |
20009 |
26.7 |
-0.1 |
0.487 |
0 |
0 |
0 |
0.000 |
60 |
63 |
|
[GOL]B:1506 |
1 |
1 |
220 |
◊ |
[GOL]B:1500 |
x,y,z |
1_555 |
2 |
1 |
220 |
20.4 |
0.5 |
0.612 |
1 |
0 |
0 |
0.000 |
61 |
64 |
|
[CHQ]A:1514 |
2 |
1 |
395 |
f |
[GOL]A:1500 |
x,y,z |
1_555 |
3 |
1 |
219 |
15.2 |
-0.1 |
0.459 |
0 |
0 |
0 |
0.000 |
62 |
65 |
|
[GOL]B:1505 |
2 |
1 |
220 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
20179 |
14.5 |
0.2 |
0.671 |
0 |
0 |
0 |
0.000 |
63 |
66 |
|
[CHQ]B:1513 |
1 |
1 |
398 |
f |
[GOL]B:1506 |
x,y,z |
1_555 |
2 |
1 |
220 |
12.1 |
-0.2 |
0.454 |
0 |
0 |
0 |
0.001 |
64 |
67 |
|
[CHQ]B:1513 |
1 |
1 |
398 |
◊ |
[GOL]B:1500 |
x,y,z |
1_555 |
2 |
1 |
220 |
11.8 |
-0.1 |
0.454 |
0 |
0 |
0 |
0.001 |
65 |
68 |
|
[SO4]B:1511 |
1 |
1 |
187 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
20009 |
11.5 |
-1.3 |
0.820 |
0 |
0 |
0 |
0.000 |
66 |
69 |
|
[GOL]A:1505 |
2 |
1 |
221 |
f |
[GOL]A:1500 |
x,y,z |
1_555 |
1 |
1 |
219 |
10.6 |
0.2 |
0.540 |
0 |
0 |
0 |
0.000 |
67 |
70 |
|
[GOL]B:1504 |
1 |
1 |
218 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
20009 |
3.6 |
-0.1 |
0.413 |
0 |
0 |
0 |
0.000 |
|