## |
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 |
|
C |
422 |
125 |
31494 |
◊ |
B |
x,y,z |
1_555 |
369 |
109 |
31448 |
3856.1 |
-29.7 |
0.108 |
43 |
26 |
0 |
0.688 |
2 |
|
D |
407 |
118 |
32101 |
◊ |
C |
x,y,z |
1_555 |
374 |
110 |
31494 |
3788.3 |
-26.6 |
0.158 |
40 |
25 |
0 |
0.688 |
3 |
|
B |
396 |
118 |
31448 |
◊ |
A |
x,y,z |
1_555 |
379 |
109 |
31387 |
3718.1 |
-27.6 |
0.134 |
44 |
28 |
0 |
0.688 |
4 |
|
E |
394 |
122 |
31833 |
◊ |
D |
x,y,z |
1_555 |
366 |
106 |
32101 |
3702.4 |
-26.1 |
0.162 |
42 |
28 |
0 |
0.688 |
5 |
|
F |
387 |
115 |
31804 |
◊ |
E |
x,y,z |
1_555 |
362 |
109 |
31833 |
3640.3 |
-25.5 |
0.172 |
40 |
21 |
0 |
0.688 |
6 |
|
F |
325 |
98 |
31804 |
◊ |
A |
x,y,z |
1_555 |
368 |
111 |
31387 |
3331.6 |
-20.4 |
0.258 |
31 |
21 |
0 |
0.688 |
Average: |
3672.8 |
-26.0 |
0.165 |
40 |
25 |
0 |
0.688 |
2 |
7 |
|
A |
95 |
28 |
31387 |
◊ |
E |
-x+1/2,y-1/2,-z+1/4 |
5_545 |
90 |
24 |
31833 |
795.3 |
0.9 |
0.769 |
4 |
1 |
0 |
0.000 |
3 |
8 |
|
B |
57 |
15 |
31448 |
◊ |
F |
-y+1/2,x-1/2,z+1/4 |
3_545 |
57 |
16 |
31804 |
481.4 |
4.0 |
0.871 |
6 |
8 |
0 |
0.000 |
4 |
9 |
|
C |
53 |
14 |
31494 |
◊ |
F |
-y+1/2,x-1/2,z+1/4 |
3_545 |
44 |
14 |
31804 |
446.5 |
-1.5 |
0.544 |
4 |
0 |
0 |
0.000 |
10 |
|
B |
45 |
12 |
31448 |
◊ |
A |
-y+1/2,x-1/2,z+1/4 |
3_545 |
51 |
13 |
31387 |
428.0 |
-2.4 |
0.456 |
6 |
0 |
0 |
0.000 |
Average: |
437.2 |
-1.9 |
0.500 |
5 |
0 |
0 |
0.000 |
5 |
11 |
|
[08T]C:2001 |
30 |
1 |
636 |
f |
C |
x,y,z |
1_555 |
50 |
18 |
31494 |
327.0 |
-2.1 |
0.403 |
15 |
0 |
0 |
0.311 |
12 |
|
[08T]A:2001 |
30 |
1 |
635 |
f |
A |
x,y,z |
1_555 |
48 |
16 |
31387 |
323.7 |
-2.0 |
0.393 |
14 |
0 |
0 |
0.311 |
13 |
|
[08T]B:2001 |
29 |
1 |
633 |
f |
B |
x,y,z |
1_555 |
45 |
15 |
31448 |
321.3 |
-2.2 |
0.369 |
13 |
0 |
0 |
0.311 |
Average: |
324.0 |
-2.1 |
0.388 |
14 |
0 |
0 |
0.311 |
6 |
14 |
|
[ADP]F:2001 |
26 |
1 |
560 |
f |
F |
x,y,z |
1_555 |
44 |
15 |
31804 |
302.8 |
-4.4 |
0.464 |
12 |
0 |
0 |
0.073 |
15 |
|
[ADP]E:2001 |
25 |
1 |
558 |
f |
E |
x,y,z |
1_555 |
44 |
16 |
31833 |
287.3 |
-5.4 |
0.377 |
11 |
0 |
0 |
0.073 |
16 |
|
[ADP]D:2001 |
26 |
1 |
559 |
f |
D |
x,y,z |
1_555 |
44 |
16 |
32101 |
284.4 |
-4.8 |
0.417 |
12 |
0 |
0 |
0.073 |
Average: |
291.5 |
-4.9 |
0.419 |
12 |
0 |
0 |
0.073 |
7 |
17 |
|
X |
35 |
4 |
2428 |
◊ |
B |
x,y,z |
1_555 |
32 |
11 |
31448 |
264.9 |
-6.8 |
0.532 |
7 |
0 |
0 |
0.384 |
8 |
18 |
|
X |
33 |
5 |
2428 |
◊ |
C |
x,y,z |
1_555 |
29 |
11 |
31494 |
251.5 |
-5.4 |
0.577 |
5 |
0 |
0 |
0.032 |
9 |
19 |
|
X |
27 |
5 |
2428 |
◊ |
E |
x,y,z |
1_555 |
26 |
9 |
31833 |
233.7 |
-4.9 |
0.507 |
4 |
0 |
0 |
0.015 |
10 |
20 |
|
X |
31 |
4 |
2428 |
◊ |
D |
x,y,z |
1_555 |
26 |
9 |
32101 |
231.9 |
-4.6 |
0.553 |
4 |
0 |
0 |
0.014 |
11 |
21 |
|
X |
25 |
5 |
2428 |
◊ |
F |
x,y,z |
1_555 |
29 |
9 |
31804 |
213.7 |
-4.7 |
0.563 |
4 |
0 |
0 |
0.014 |
12 |
22 |
|
[08T]C:2001 |
25 |
1 |
636 |
◊ |
D |
x,y,z |
1_555 |
33 |
11 |
32101 |
206.5 |
0.5 |
0.637 |
4 |
0 |
0 |
0.016 |
23 |
|
[08T]B:2001 |
24 |
1 |
633 |
◊ |
C |
x,y,z |
1_555 |
32 |
10 |
31494 |
202.7 |
0.1 |
0.618 |
6 |
0 |
0 |
0.016 |
24 |
|
[08T]A:2001 |
24 |
1 |
635 |
◊ |
B |
x,y,z |
1_555 |
31 |
11 |
31448 |
199.5 |
0.4 |
0.614 |
7 |
0 |
0 |
0.016 |
Average: |
202.9 |
0.3 |
0.623 |
6 |
0 |
0 |
0.016 |
13 |
25 |
|
[ADP]E:2001 |
22 |
1 |
558 |
◊ |
F |
x,y,z |
1_555 |
26 |
9 |
31804 |
176.9 |
-1.5 |
0.706 |
5 |
0 |
0 |
0.017 |
26 |
|
[ADP]D:2001 |
22 |
1 |
559 |
◊ |
E |
x,y,z |
1_555 |
28 |
9 |
31833 |
175.5 |
-1.9 |
0.695 |
3 |
0 |
0 |
0.017 |
Average: |
176.2 |
-1.7 |
0.700 |
4 |
0 |
0 |
0.017 |
14 |
27 |
|
X |
15 |
2 |
2428 |
◊ |
A |
x,y,z |
1_555 |
23 |
10 |
31387 |
174.9 |
-6.4 |
0.307 |
1 |
0 |
0 |
0.015 |
15 |
28 |
|
[ADP]F:2001 |
17 |
1 |
560 |
◊ |
A |
x,y,z |
1_555 |
25 |
6 |
31387 |
153.8 |
-2.0 |
0.569 |
3 |
0 |
0 |
0.008 |
16 |
29 |
|
E |
16 |
5 |
31833 |
◊ |
E |
-y+1,-x+1,-z+1/2 |
8_665 |
16 |
5 |
31833 |
142.2 |
1.7 |
0.827 |
0 |
0 |
0 |
0.000 |
17 |
30 |
|
D |
8 |
3 |
32101 |
◊ |
A |
-y,-x+1,-z+1/2 |
8_565 |
11 |
5 |
31387 |
117.9 |
-2.2 |
0.126 |
0 |
0 |
0 |
0.000 |
18 |
31 |
|
B |
15 |
6 |
31448 |
◊ |
F |
-x+1/2,y-1/2,-z+1/4 |
5_545 |
12 |
4 |
31804 |
104.4 |
0.1 |
0.626 |
0 |
0 |
0 |
0.000 |
19 |
32 |
|
D |
9 |
4 |
32101 |
◊ |
C |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
13 |
6 |
31494 |
81.3 |
0.7 |
0.731 |
1 |
0 |
0 |
0.000 |
20 |
33 |
|
D |
5 |
2 |
32101 |
◊ |
E |
-y+1/2,x+1/2,z+1/4 |
3_555 |
9 |
3 |
31833 |
69.9 |
1.1 |
0.794 |
3 |
1 |
0 |
0.000 |
21 |
34 |
|
E |
6 |
3 |
31833 |
◊ |
C |
x,y,z |
1_555 |
8 |
2 |
31494 |
51.6 |
0.5 |
0.700 |
0 |
0 |
0 |
0.000 |
35 |
|
F |
3 |
2 |
31804 |
◊ |
D |
x,y,z |
1_555 |
7 |
3 |
32101 |
48.3 |
1.0 |
0.832 |
0 |
0 |
0 |
0.000 |
36 |
|
D |
5 |
2 |
32101 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
31448 |
44.3 |
0.8 |
0.763 |
0 |
0 |
0 |
0.000 |
37 |
|
E |
5 |
1 |
31833 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
31387 |
42.2 |
0.2 |
0.693 |
0 |
0 |
0 |
0.000 |
38 |
|
C |
4 |
1 |
31494 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
31387 |
41.5 |
0.5 |
0.709 |
1 |
0 |
0 |
0.000 |
39 |
|
F |
4 |
2 |
31804 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
31448 |
17.5 |
-0.1 |
0.561 |
0 |
0 |
0 |
0.000 |
Average: |
40.9 |
0.5 |
0.710 |
0 |
0 |
0 |
0.000 |
22 |
40 |
|
[MG]F:2003 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
10 |
4 |
31804 |
42.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.152 |
41 |
|
[MG]E:2003 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
9 |
4 |
31833 |
37.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.152 |
42 |
|
[MG]D:2003 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
32101 |
37.5 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.152 |
43 |
|
[MG]A:2003 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
31387 |
33.8 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.152 |
44 |
|
[MG]B:2003 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
31448 |
33.7 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.152 |
45 |
|
[MG]C:2003 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
31494 |
32.4 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.152 |
Average: |
36.3 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.152 |
23 |
46 |
|
[MG]C:2003 |
1 |
1 |
98 |
f |
[08T]C:2001 |
x,y,z |
1_555 |
4 |
1 |
636 |
30.4 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.152 |
47 |
|
[MG]A:2003 |
1 |
1 |
98 |
f |
[08T]A:2001 |
x,y,z |
1_555 |
4 |
1 |
635 |
29.9 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.152 |
48 |
|
[MG]B:2003 |
1 |
1 |
98 |
f |
[08T]B:2001 |
x,y,z |
1_555 |
4 |
1 |
633 |
29.6 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.152 |
Average: |
30.0 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.152 |
24 |
49 |
|
B |
3 |
1 |
31448 |
◊ |
E |
-x+1/2,y-1/2,-z+1/4 |
5_545 |
3 |
1 |
31833 |
30.3 |
1.1 |
0.891 |
2 |
2 |
0 |
0.000 |
25 |
50 |
|
[ADP]F:2001 |
4 |
1 |
560 |
f |
[MG]F:2003 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.2 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.031 |
51 |
|
[ADP]E:2001 |
4 |
1 |
558 |
f |
[MG]E:2003 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.031 |
52 |
|
[ADP]D:2001 |
4 |
1 |
559 |
f |
[MG]D:2003 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.1 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.031 |
Average: |
28.1 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.031 |
26 |
53 |
|
C |
1 |
1 |
31494 |
◊ |
A |
-y+1/2,x-1/2,z+1/4 |
3_545 |
1 |
1 |
31387 |
28.4 |
0.8 |
0.939 |
0 |
0 |
0 |
0.000 |
27 |
54 |
|
[MG]D:2003 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
5 |
3 |
31833 |
26.9 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.019 |
55 |
|
[MG]E:2003 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
5 |
3 |
31804 |
24.7 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.019 |
56 |
|
[MG]C:2003 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
6 |
4 |
32101 |
24.5 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.019 |
57 |
|
[MG]B:2003 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
6 |
4 |
31494 |
24.2 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.019 |
58 |
|
[MG]F:2003 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
31387 |
18.4 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.019 |
Average: |
23.8 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.019 |
28 |
59 |
|
[MG]A:2003 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
31448 |
23.4 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.004 |
29 |
60 |
|
C |
2 |
1 |
31494 |
x |
C |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
4 |
3 |
31494 |
23.0 |
1.2 |
0.870 |
0 |
0 |
0 |
0.000 |
30 |
61 |
|
F |
1 |
1 |
31804 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
31494 |
8.4 |
-0.0 |
0.444 |
0 |
0 |
0 |
0.000 |
31 |
62 |
|
C |
1 |
1 |
31494 |
◊ |
F |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
1 |
1 |
31804 |
1.0 |
-0.0 |
0.528 |
0 |
0 |
0 |
0.000 |
|