## |
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 |
127 |
29 |
17754 |
◊ |
A |
x,y,z |
1_555 |
129 |
30 |
17818 |
1140.2 |
-8.7 |
0.339 |
19 |
8 |
0 |
0.072 |
2 |
|
D |
126 |
30 |
17867 |
◊ |
C |
x,y,z |
1_555 |
127 |
31 |
17713 |
1134.6 |
-10.1 |
0.267 |
13 |
8 |
0 |
0.072 |
3 |
|
F |
123 |
28 |
17558 |
◊ |
E |
x,y,z |
1_555 |
123 |
30 |
17982 |
1113.5 |
-10.9 |
0.235 |
15 |
8 |
0 |
0.072 |
Average: |
1129.4 |
-9.9 |
0.280 |
16 |
8 |
0 |
0.072 |
2 |
4 |
|
D |
91 |
30 |
17867 |
◊ |
B |
x,y,z |
1_555 |
86 |
23 |
17754 |
787.4 |
-4.6 |
0.450 |
9 |
2 |
0 |
0.059 |
5 |
|
E |
89 |
31 |
17982 |
◊ |
A |
x,y,z |
1_555 |
87 |
24 |
17818 |
786.7 |
-1.7 |
0.642 |
9 |
2 |
0 |
0.059 |
6 |
|
F |
89 |
24 |
17558 |
◊ |
B |
x,y,z |
1_555 |
90 |
29 |
17754 |
783.8 |
-5.0 |
0.467 |
7 |
5 |
0 |
0.059 |
7 |
|
C |
90 |
24 |
17713 |
◊ |
A |
x,y,z |
1_555 |
88 |
28 |
17818 |
776.7 |
-4.8 |
0.457 |
7 |
2 |
0 |
0.059 |
8 |
|
E |
86 |
22 |
17982 |
◊ |
C |
x,y,z |
1_555 |
86 |
30 |
17713 |
776.5 |
-4.4 |
0.457 |
10 |
2 |
0 |
0.059 |
9 |
|
F |
85 |
29 |
17558 |
◊ |
D |
x,y,z |
1_555 |
89 |
23 |
17867 |
771.6 |
-3.6 |
0.551 |
11 |
2 |
0 |
0.059 |
Average: |
780.4 |
-4.0 |
0.504 |
9 |
3 |
0 |
0.059 |
3 |
10 |
|
E |
70 |
20 |
17982 |
◊ |
D |
x-1,y,z |
1_455 |
74 |
23 |
17867 |
668.7 |
0.5 |
0.747 |
5 |
2 |
0 |
0.000 |
4 |
11 |
|
A |
40 |
13 |
17818 |
◊ |
C |
x-1/2,-y-1/2,-z+1 |
4_446 |
42 |
12 |
17713 |
373.3 |
-0.6 |
0.593 |
2 |
3 |
0 |
0.000 |
5 |
12 |
|
A |
44 |
16 |
17818 |
x |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
35 |
11 |
17818 |
334.0 |
-1.2 |
0.571 |
4 |
1 |
0 |
0.000 |
6 |
13 |
|
D |
32 |
12 |
17867 |
◊ |
F |
-x+1,y-1/2,-z+1/2 |
3_645 |
33 |
10 |
17558 |
290.8 |
1.7 |
0.813 |
3 |
3 |
0 |
0.000 |
7 |
14 |
|
C |
24 |
10 |
17713 |
◊ |
B |
x,y-1,z |
1_545 |
22 |
6 |
17754 |
244.6 |
2.5 |
0.843 |
4 |
4 |
0 |
0.000 |
8 |
15 |
|
D |
33 |
12 |
17867 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
33 |
13 |
17754 |
235.6 |
1.6 |
0.803 |
1 |
0 |
0 |
0.000 |
9 |
16 |
|
[MPD]E:504 |
7 |
1 |
276 |
f |
E |
x,y,z |
1_555 |
31 |
11 |
17982 |
192.9 |
-13.5 |
0.414 |
1 |
0 |
0 |
0.054 |
10 |
17 |
|
F |
19 |
6 |
17558 |
◊ |
A |
x,y,z |
1_555 |
22 |
6 |
17818 |
189.5 |
0.2 |
0.687 |
4 |
0 |
0 |
0.004 |
18 |
|
E |
19 |
6 |
17982 |
◊ |
D |
x,y,z |
1_555 |
18 |
6 |
17867 |
183.0 |
-0.1 |
0.636 |
2 |
0 |
0 |
0.004 |
19 |
|
C |
19 |
6 |
17713 |
◊ |
B |
x,y,z |
1_555 |
17 |
5 |
17754 |
178.9 |
0.1 |
0.664 |
3 |
0 |
0 |
0.004 |
Average: |
183.8 |
0.1 |
0.663 |
3 |
0 |
0 |
0.004 |
11 |
20 |
|
[MPD]D:502 |
7 |
1 |
277 |
f |
D |
x,y,z |
1_555 |
28 |
9 |
17867 |
186.4 |
-11.5 |
0.714 |
1 |
0 |
0 |
0.043 |
12 |
21 |
|
[MPD]B:501 |
7 |
1 |
277 |
f |
B |
x,y,z |
1_555 |
25 |
10 |
17754 |
186.3 |
-12.9 |
0.497 |
1 |
0 |
0 |
0.045 |
13 |
22 |
|
[MPD]C:502 |
7 |
1 |
277 |
f |
C |
x,y,z |
1_555 |
30 |
11 |
17713 |
183.4 |
-12.7 |
0.477 |
0 |
0 |
0 |
0.046 |
14 |
23 |
|
[MPD]A:504 |
7 |
1 |
280 |
f |
A |
x,y,z |
1_555 |
28 |
10 |
17818 |
177.2 |
-11.6 |
0.473 |
1 |
0 |
0 |
0.041 |
15 |
24 |
|
E |
17 |
6 |
17982 |
◊ |
F |
-x,y-1/2,-z+1/2 |
3_545 |
20 |
9 |
17558 |
155.5 |
-0.7 |
0.542 |
0 |
0 |
0 |
0.000 |
16 |
25 |
|
[MPD]A:502 |
7 |
1 |
279 |
f |
A |
x,y,z |
1_555 |
20 |
10 |
17818 |
150.5 |
-10.5 |
0.508 |
0 |
0 |
0 |
0.035 |
17 |
26 |
|
[MPD]A:501 |
7 |
1 |
276 |
f |
A |
x,y,z |
1_555 |
23 |
12 |
17818 |
150.3 |
-10.4 |
0.622 |
0 |
0 |
0 |
0.035 |
18 |
27 |
|
[MPD]C:503 |
6 |
1 |
278 |
f |
C |
x,y,z |
1_555 |
22 |
11 |
17713 |
149.3 |
-10.3 |
0.554 |
2 |
0 |
0 |
0.040 |
19 |
28 |
|
[MPD]E:503 |
7 |
1 |
279 |
f |
E |
x,y,z |
1_555 |
21 |
8 |
17982 |
139.0 |
-9.6 |
0.537 |
2 |
0 |
0 |
0.040 |
20 |
29 |
|
[MPD]A:503 |
7 |
1 |
275 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
17818 |
132.5 |
-9.2 |
0.531 |
0 |
0 |
0 |
0.031 |
21 |
30 |
|
[K]E:502 |
1 |
1 |
216 |
f |
E |
x,y,z |
1_555 |
24 |
8 |
17982 |
119.2 |
-88.0 |
0.000 |
0 |
0 |
0 |
0.670 |
31 |
|
[K]A:505 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
23 |
8 |
17818 |
119.1 |
-88.1 |
0.000 |
0 |
0 |
0 |
0.670 |
32 |
|
[K]E:505 |
1 |
1 |
216 |
f |
F |
x,y,z |
1_555 |
21 |
8 |
17558 |
118.0 |
-86.0 |
0.000 |
0 |
0 |
0 |
0.670 |
33 |
|
[K]D:501 |
1 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
21 |
8 |
17867 |
118.0 |
-87.6 |
0.000 |
0 |
0 |
0 |
0.670 |
34 |
|
[K]C:501 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
20 |
8 |
17713 |
117.9 |
-87.0 |
0.000 |
0 |
0 |
0 |
0.670 |
35 |
|
[K]A:506 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
21 |
8 |
17754 |
117.0 |
-86.9 |
0.000 |
0 |
0 |
0 |
0.670 |
Average: |
118.2 |
-87.3 |
0.000 |
0 |
0 |
0 |
0.670 |
22 |
36 |
|
E |
14 |
6 |
17982 |
◊ |
C |
x-1/2,-y-1/2,-z+1 |
4_446 |
17 |
7 |
17713 |
116.6 |
0.0 |
0.637 |
0 |
0 |
0 |
0.000 |
23 |
37 |
|
[MPD]E:501 |
5 |
1 |
275 |
f |
C |
x-1/2,-y-1/2,-z+1 |
4_446 |
18 |
7 |
17713 |
113.5 |
-6.3 |
0.827 |
1 |
0 |
0 |
0.024 |
24 |
38 |
|
[MPD]E:503 |
5 |
1 |
279 |
◊ |
C |
x,y,z |
1_555 |
13 |
8 |
17713 |
89.1 |
-6.1 |
0.473 |
0 |
0 |
0 |
0.015 |
25 |
39 |
|
[MPD]A:503 |
6 |
1 |
275 |
◊ |
E |
x,y,z |
1_555 |
12 |
8 |
17982 |
88.1 |
-6.1 |
0.456 |
0 |
0 |
0 |
0.016 |
26 |
40 |
|
[MPD]E:501 |
5 |
1 |
275 |
◊ |
E |
x,y,z |
1_555 |
8 |
3 |
17982 |
85.8 |
-4.2 |
0.901 |
2 |
0 |
0 |
0.000 |
27 |
41 |
|
D |
7 |
2 |
17867 |
◊ |
B |
x,y-1,z |
1_545 |
6 |
1 |
17754 |
74.2 |
-1.0 |
0.297 |
0 |
0 |
0 |
0.000 |
28 |
42 |
|
[MPD]E:501 |
4 |
1 |
275 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
17818 |
45.8 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
29 |
43 |
|
[K]A:506 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
17818 |
44.4 |
-20.9 |
0.000 |
0 |
0 |
0 |
0.164 |
44 |
|
[K]E:505 |
1 |
1 |
216 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
17982 |
44.4 |
-21.8 |
0.000 |
0 |
0 |
0 |
0.164 |
45 |
|
[K]D:501 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
4 |
1 |
17713 |
43.3 |
-21.1 |
0.000 |
0 |
0 |
0 |
0.164 |
46 |
|
[K]E:502 |
1 |
1 |
216 |
◊ |
F |
x,y,z |
1_555 |
4 |
1 |
17558 |
43.2 |
-20.8 |
0.000 |
0 |
0 |
0 |
0.164 |
47 |
|
[K]A:505 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
17754 |
42.9 |
-20.8 |
0.000 |
0 |
0 |
0 |
0.164 |
48 |
|
[K]C:501 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
17867 |
42.3 |
-20.8 |
0.000 |
0 |
0 |
0 |
0.164 |
Average: |
43.4 |
-21.0 |
0.000 |
0 |
0 |
0 |
0.164 |
30 |
49 |
|
[MPD]A:504 |
2 |
1 |
280 |
◊ |
B |
x,y,z |
1_555 |
10 |
2 |
17754 |
42.3 |
-2.7 |
0.585 |
0 |
0 |
0 |
0.009 |
31 |
50 |
|
A |
4 |
1 |
17818 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
4 |
2 |
17754 |
39.4 |
0.3 |
0.722 |
0 |
0 |
0 |
0.000 |
32 |
51 |
|
[MPD]B:501 |
3 |
1 |
277 |
◊ |
[MPD]A:504 |
x,y,z |
1_555 |
1 |
1 |
280 |
17.8 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.006 |
33 |
52 |
|
F |
3 |
1 |
17558 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
17713 |
14.6 |
-0.1 |
0.351 |
0 |
0 |
0 |
0.000 |
53 |
|
D |
1 |
1 |
17867 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
17818 |
6.9 |
-0.2 |
0.273 |
0 |
0 |
0 |
0.000 |
54 |
|
E |
1 |
1 |
17982 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
17754 |
3.2 |
-0.0 |
0.522 |
0 |
0 |
0 |
0.000 |
Average: |
8.2 |
-0.1 |
0.382 |
0 |
0 |
0 |
0.000 |
34 |
55 |
|
F |
3 |
3 |
17558 |
x |
F |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
2 |
17558 |
6.5 |
0.4 |
0.811 |
0 |
0 |
0 |
0.000 |
|