| ## |
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 |
343 |
90 |
22095 |
◊ |
C |
x,y,z |
1_555 |
347 |
95 |
21708 |
3189.1 |
-35.2 |
0.079 |
47 |
8 |
0 |
0.594 |
2 |
|
B |
342 |
91 |
22223 |
◊ |
A |
x,y,z |
1_555 |
336 |
90 |
21660 |
3167.7 |
-32.1 |
0.114 |
47 |
6 |
0 |
0.594 |
| Average: |
3178.4 |
-33.7 |
0.097 |
47 |
7 |
0 |
0.594 |
| 2 |
3 |
|
C |
60 |
24 |
21708 |
◊ |
D |
x-1,y+1,z |
1_465 |
70 |
26 |
22095 |
608.8 |
-0.3 |
0.747 |
3 |
3 |
0 |
0.000 |
| 3 |
4 |
|
A |
59 |
20 |
21660 |
◊ |
B |
x,y-1,z |
1_545 |
81 |
27 |
22223 |
606.4 |
-2.3 |
0.662 |
4 |
2 |
0 |
0.000 |
| 4 |
5 |
|
D |
55 |
13 |
22095 |
◊ |
A |
x,y,z |
1_555 |
52 |
13 |
21660 |
482.9 |
-1.5 |
0.673 |
8 |
5 |
0 |
0.000 |
6 |
|
C |
48 |
14 |
21708 |
◊ |
B |
x,y,z |
1_555 |
48 |
14 |
22223 |
466.3 |
-1.1 |
0.682 |
9 |
6 |
0 |
0.000 |
| Average: |
474.6 |
-1.3 |
0.678 |
9 |
6 |
0 |
0.000 |
| 5 |
7 |
|
B |
43 |
17 |
22223 |
◊ |
A |
x-1,y+1,z |
1_465 |
53 |
17 |
21660 |
455.7 |
-2.9 |
0.522 |
1 |
1 |
0 |
0.000 |
| 6 |
8 |
|
B |
61 |
19 |
22223 |
◊ |
D |
x-1,y+1,z+1 |
1_466 |
54 |
19 |
22095 |
445.6 |
-0.2 |
0.764 |
3 |
2 |
0 |
0.000 |
| 7 |
9 |
|
C |
52 |
18 |
21708 |
◊ |
A |
x,y,z-1 |
1_554 |
44 |
16 |
21660 |
404.2 |
-5.7 |
0.159 |
1 |
0 |
0 |
0.000 |
| 8 |
10 |
|
A |
39 |
14 |
21660 |
◊ |
C |
x-1,y,z+1 |
1_456 |
36 |
14 |
21708 |
332.7 |
-2.2 |
0.447 |
3 |
1 |
0 |
0.000 |
| 9 |
11 |
|
[TPP]A:600 |
26 |
1 |
607 |
f |
A |
x,y,z |
1_555 |
49 |
21 |
21660 |
325.9 |
-8.2 |
0.474 |
11 |
0 |
0 |
0.278 |
12 |
|
[TPP]C:600 |
25 |
1 |
605 |
f |
C |
x,y,z |
1_555 |
49 |
21 |
21708 |
300.1 |
-7.8 |
0.467 |
12 |
0 |
0 |
0.278 |
13 |
|
[TPP]B:600 |
25 |
1 |
602 |
f |
B |
x,y,z |
1_555 |
50 |
21 |
22223 |
293.0 |
-7.6 |
0.466 |
12 |
0 |
0 |
0.278 |
14 |
|
[TPP]D:600 |
26 |
1 |
602 |
f |
D |
x,y,z |
1_555 |
50 |
21 |
22095 |
292.1 |
-7.7 |
0.464 |
12 |
0 |
0 |
0.278 |
| Average: |
302.8 |
-7.8 |
0.468 |
12 |
0 |
0 |
0.278 |
| 10 |
15 |
|
D |
33 |
13 |
22095 |
◊ |
C |
x,y-1,z |
1_545 |
41 |
19 |
21708 |
297.0 |
-2.6 |
0.485 |
2 |
0 |
0 |
0.000 |
| 11 |
16 |
|
B |
31 |
11 |
22223 |
◊ |
D |
x-1,y+1,z |
1_465 |
32 |
13 |
22095 |
287.2 |
-2.0 |
0.384 |
4 |
0 |
0 |
0.000 |
| 12 |
17 |
|
C |
24 |
7 |
21708 |
◊ |
D |
x-1,y,z |
1_455 |
32 |
10 |
22095 |
259.6 |
-1.1 |
0.542 |
2 |
0 |
0 |
0.000 |
18 |
|
A |
29 |
9 |
21660 |
◊ |
B |
x-1,y,z |
1_455 |
26 |
9 |
22223 |
242.8 |
-0.0 |
0.661 |
2 |
3 |
0 |
0.000 |
| Average: |
251.2 |
-0.6 |
0.602 |
2 |
2 |
0 |
0.000 |
| 13 |
19 |
|
[TPP]A:600 |
13 |
1 |
607 |
◊ |
B |
x,y,z |
1_555 |
21 |
9 |
22223 |
146.6 |
1.2 |
0.684 |
0 |
0 |
0 |
0.000 |
20 |
|
[TPP]C:600 |
12 |
1 |
605 |
◊ |
D |
x,y,z |
1_555 |
20 |
9 |
22095 |
128.5 |
0.6 |
0.575 |
0 |
0 |
0 |
0.000 |
21 |
|
[TPP]B:600 |
13 |
1 |
602 |
◊ |
A |
x,y,z |
1_555 |
20 |
9 |
21660 |
126.5 |
0.5 |
0.531 |
0 |
0 |
0 |
0.000 |
22 |
|
[TPP]D:600 |
13 |
1 |
602 |
◊ |
C |
x,y,z |
1_555 |
20 |
9 |
21708 |
125.8 |
0.6 |
0.557 |
0 |
0 |
0 |
0.000 |
| Average: |
131.8 |
0.7 |
0.587 |
0 |
0 |
0 |
0.000 |
| 14 |
23 |
|
[PY0]A:603 |
7 |
1 |
230 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
21660 |
136.7 |
4.0 |
0.582 |
8 |
0 |
0 |
0.000 |
| 15 |
24 |
|
[PY0]B:603 |
7 |
1 |
234 |
cf |
B |
x,y,z |
1_555 |
15 |
9 |
22223 |
132.9 |
4.3 |
0.630 |
4 |
0 |
0 |
0.000 |
25 |
|
[PY0]C:603 |
7 |
1 |
233 |
f |
C |
x,y,z |
1_555 |
14 |
8 |
21708 |
132.9 |
4.4 |
0.636 |
5 |
0 |
0 |
0.000 |
| Average: |
132.9 |
4.3 |
0.633 |
5 |
0 |
0 |
0.000 |
| 16 |
26 |
|
[PY0]D:603 |
7 |
1 |
234 |
cf |
D |
x,y,z |
1_555 |
18 |
9 |
22095 |
132.7 |
4.1 |
0.622 |
5 |
0 |
0 |
0.000 |
| 17 |
27 |
|
[PY0]A:604 |
6 |
1 |
236 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
21660 |
114.7 |
1.7 |
0.348 |
0 |
0 |
0 |
0.000 |
| 18 |
28 |
|
[PY0]C:602 |
6 |
1 |
233 |
◊ |
C |
x,y,z |
1_555 |
14 |
7 |
21708 |
101.9 |
1.5 |
0.419 |
1 |
0 |
0 |
0.000 |
| 19 |
29 |
|
[PY0]D:602 |
7 |
1 |
234 |
f |
D |
x,y,z |
1_555 |
14 |
8 |
22095 |
96.7 |
1.6 |
0.379 |
1 |
0 |
0 |
0.000 |
30 |
|
[PY0]B:602 |
7 |
1 |
231 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
22223 |
94.4 |
1.6 |
0.403 |
1 |
0 |
0 |
0.000 |
| Average: |
95.6 |
1.6 |
0.391 |
1 |
0 |
0 |
0.000 |
| 20 |
31 |
|
D |
7 |
4 |
22095 |
◊ |
B |
x,y-1,z |
1_545 |
8 |
6 |
22223 |
79.8 |
0.5 |
0.643 |
1 |
0 |
0 |
0.000 |
| 21 |
32 |
|
[PY0]C:602 |
6 |
1 |
233 |
f |
D |
x,y,z |
1_555 |
14 |
5 |
22095 |
62.9 |
0.1 |
0.090 |
1 |
0 |
0 |
0.003 |
| 22 |
33 |
|
[PY0]D:602 |
7 |
1 |
234 |
◊ |
C |
x,y,z |
1_555 |
14 |
7 |
21708 |
60.6 |
0.1 |
0.046 |
1 |
0 |
0 |
0.004 |
34 |
|
[PY0]B:602 |
6 |
1 |
231 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
21660 |
57.9 |
0.1 |
0.079 |
1 |
0 |
0 |
0.004 |
| Average: |
59.3 |
0.1 |
0.062 |
1 |
0 |
0 |
0.004 |
| 23 |
35 |
|
[PY0]D:602 |
5 |
1 |
234 |
f |
[TPP]D:600 |
x,y,z |
1_555 |
6 |
1 |
602 |
54.2 |
1.6 |
0.492 |
1 |
0 |
0 |
0.000 |
36 |
|
[PY0]B:602 |
5 |
1 |
231 |
cf |
[TPP]B:600 |
x,y,z |
1_555 |
5 |
1 |
602 |
52.6 |
1.4 |
0.479 |
1 |
0 |
0 |
0.000 |
| Average: |
53.4 |
1.5 |
0.485 |
1 |
0 |
0 |
0.000 |
| 24 |
37 |
|
[PY0]C:602 |
5 |
1 |
233 |
◊ |
[TPP]C:600 |
x,y,z |
1_555 |
7 |
1 |
605 |
52.6 |
1.5 |
0.392 |
1 |
0 |
0 |
0.000 |
| 25 |
38 |
|
A |
8 |
5 |
21660 |
◊ |
D |
x-1,y+1,z+1 |
1_466 |
6 |
4 |
22095 |
49.0 |
0.1 |
0.670 |
0 |
0 |
0 |
0.000 |
| 26 |
39 |
|
D |
2 |
1 |
22095 |
◊ |
A |
x,y,z-1 |
1_554 |
7 |
4 |
21660 |
38.6 |
0.4 |
0.762 |
1 |
0 |
0 |
0.000 |
| 27 |
40 |
|
[MG]A:601 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
21660 |
36.5 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.128 |
41 |
|
[MG]D:601 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
7 |
22095 |
36.4 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.128 |
42 |
|
[MG]C:601 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
7 |
21708 |
36.1 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.128 |
43 |
|
[MG]B:601 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
22223 |
36.0 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.128 |
| Average: |
36.3 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.128 |
| 28 |
44 |
|
B |
9 |
4 |
22223 |
◊ |
C |
x-1,y+1,z+1 |
1_466 |
3 |
2 |
21708 |
33.4 |
0.4 |
0.702 |
0 |
0 |
0 |
0.000 |
| 29 |
45 |
|
[MG]A:601 |
1 |
1 |
98 |
f |
[TPP]A:600 |
x,y,z |
1_555 |
4 |
1 |
607 |
30.7 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.106 |
46 |
|
[MG]C:601 |
1 |
1 |
98 |
f |
[TPP]C:600 |
x,y,z |
1_555 |
5 |
1 |
605 |
30.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.106 |
47 |
|
[MG]B:601 |
1 |
1 |
98 |
f |
[TPP]B:600 |
x,y,z |
1_555 |
5 |
1 |
602 |
30.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.106 |
48 |
|
[MG]D:601 |
1 |
1 |
98 |
f |
[TPP]D:600 |
x,y,z |
1_555 |
4 |
1 |
602 |
29.5 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.106 |
| Average: |
30.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.106 |
| 30 |
49 |
|
A |
3 |
2 |
21660 |
◊ |
D |
x-1,y+1,z |
1_465 |
4 |
3 |
22095 |
22.2 |
-0.1 |
0.466 |
0 |
0 |
0 |
0.000 |
|