## |
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 |
282 |
74 |
20952 |
◊ |
A |
x,y,z |
1_555 |
287 |
76 |
21607 |
2853.0 |
-36.0 |
0.173 |
28 |
10 |
0 |
0.181 |
2 |
|
D |
287 |
73 |
17455 |
◊ |
B |
x,y,z |
1_555 |
282 |
73 |
21716 |
2790.9 |
-35.5 |
0.197 |
28 |
12 |
0 |
0.181 |
Average: |
2821.9 |
-35.8 |
0.185 |
28 |
11 |
0 |
0.181 |
2 |
3 |
|
A |
121 |
35 |
21607 |
◊ |
D |
x,y,z-1 |
1_554 |
119 |
35 |
17455 |
1209.6 |
-10.8 |
0.530 |
15 |
6 |
0 |
0.117 |
4 |
|
C |
122 |
36 |
20952 |
◊ |
B |
x,y,z-1 |
1_554 |
118 |
33 |
21716 |
1200.8 |
-12.5 |
0.410 |
15 |
8 |
0 |
0.117 |
Average: |
1205.2 |
-11.7 |
0.470 |
15 |
7 |
0 |
0.117 |
3 |
5 |
|
B |
69 |
25 |
21716 |
◊ |
A |
x,y,z |
1_555 |
73 |
26 |
21607 |
632.2 |
-2.6 |
0.726 |
7 |
4 |
0 |
0.000 |
4 |
6 |
|
A |
22 |
9 |
21607 |
◊ |
C |
x-1,y,z |
1_455 |
24 |
7 |
20952 |
215.8 |
-5.1 |
0.142 |
0 |
0 |
0 |
0.010 |
5 |
7 |
|
A |
21 |
8 |
21607 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
25 |
8 |
20952 |
197.8 |
-2.1 |
0.514 |
1 |
2 |
0 |
0.000 |
6 |
8 |
|
B |
22 |
7 |
21716 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
18 |
5 |
17455 |
164.7 |
-1.0 |
0.638 |
1 |
1 |
0 |
0.000 |
7 |
9 |
|
[GOL]C:602 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
27 |
12 |
20952 |
150.8 |
-0.3 |
0.681 |
6 |
0 |
0 |
0.010 |
8 |
10 |
|
[GOL]B:604 |
6 |
1 |
214 |
f |
B |
x,y,z |
1_555 |
23 |
10 |
21716 |
145.8 |
-0.5 |
0.635 |
3 |
0 |
0 |
0.006 |
9 |
11 |
|
[GOL]B:603 |
6 |
1 |
222 |
f |
B |
x,y,z |
1_555 |
32 |
11 |
21716 |
145.4 |
-0.5 |
0.650 |
9 |
0 |
0 |
0.016 |
10 |
12 |
|
[GOL]A:605 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
23 |
10 |
21607 |
142.2 |
-0.2 |
0.576 |
4 |
0 |
0 |
0.012 |
11 |
13 |
|
C |
12 |
4 |
20952 |
x |
C |
-x+1,y-1/2,-z |
2_645 |
14 |
4 |
20952 |
135.8 |
-1.0 |
0.551 |
3 |
1 |
0 |
0.000 |
12 |
14 |
|
[GOL]A:603 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
30 |
11 |
21607 |
133.8 |
-0.4 |
0.578 |
6 |
0 |
0 |
0.020 |
13 |
15 |
|
[GOL]A:604 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
23 |
11 |
21607 |
126.9 |
-0.2 |
0.650 |
5 |
0 |
0 |
0.016 |
14 |
16 |
|
[FBP]A:608 |
5 |
1 |
205 |
f |
A |
x,y,z |
1_555 |
22 |
13 |
21607 |
125.7 |
-2.1 |
0.527 |
9 |
0 |
0 |
0.039 |
15 |
17 |
|
[GOL]A:602 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
16 |
10 |
21607 |
122.8 |
-0.6 |
0.558 |
2 |
0 |
0 |
0.009 |
16 |
18 |
|
[FBP]B:607 |
5 |
1 |
190 |
f |
B |
x,y,z |
1_555 |
20 |
12 |
21716 |
122.4 |
-6.0 |
0.716 |
8 |
0 |
0 |
0.035 |
17 |
19 |
|
[GOL]C:603 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
20 |
9 |
20952 |
122.2 |
-0.5 |
0.569 |
4 |
0 |
0 |
0.008 |
18 |
20 |
|
[OXL]D:602 |
6 |
1 |
197 |
f |
D |
x,y,z |
1_555 |
19 |
11 |
17455 |
116.4 |
1.6 |
0.480 |
4 |
0 |
0 |
0.003 |
19 |
21 |
|
[K]B:601 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
21716 |
116.3 |
-79.9 |
0.000 |
0 |
0 |
0 |
0.290 |
20 |
22 |
|
[K]C:601 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
15 |
12 |
20952 |
111.9 |
-86.9 |
0.000 |
0 |
0 |
0 |
0.533 |
23 |
|
[K]A:601 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
18 |
13 |
21607 |
111.6 |
-76.2 |
0.000 |
0 |
0 |
0 |
0.533 |
24 |
|
[K]B:602 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
15 |
12 |
21716 |
108.5 |
-85.8 |
0.000 |
0 |
0 |
0 |
0.533 |
Average: |
110.7 |
-82.9 |
0.000 |
0 |
0 |
0 |
0.533 |
21 |
25 |
|
[FBP]D:603 |
5 |
1 |
205 |
f |
D |
x,y,z |
1_555 |
17 |
9 |
17455 |
111.1 |
-2.3 |
0.536 |
8 |
0 |
0 |
0.090 |
22 |
26 |
|
[OXL]B:606 |
6 |
1 |
198 |
f |
B |
x,y,z |
1_555 |
16 |
10 |
21716 |
102.0 |
1.5 |
0.470 |
5 |
0 |
0 |
0.003 |
23 |
27 |
|
[OXL]C:605 |
6 |
1 |
200 |
f |
C |
x,y,z |
1_555 |
19 |
12 |
20952 |
101.6 |
1.9 |
0.601 |
5 |
0 |
0 |
0.003 |
28 |
|
[OXL]A:607 |
6 |
1 |
198 |
f |
A |
x,y,z |
1_555 |
17 |
11 |
21607 |
94.9 |
1.8 |
0.593 |
5 |
0 |
0 |
0.003 |
Average: |
98.2 |
1.8 |
0.597 |
5 |
0 |
0 |
0.003 |
24 |
29 |
|
[GOL]D:601 |
5 |
1 |
214 |
f |
D |
x,y,z |
1_555 |
9 |
3 |
17455 |
72.7 |
-0.5 |
0.572 |
0 |
0 |
0 |
0.008 |
25 |
30 |
|
B |
9 |
3 |
21716 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
9 |
4 |
20952 |
66.0 |
-1.1 |
0.424 |
0 |
0 |
0 |
0.000 |
26 |
31 |
|
[MG]C:604 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
20952 |
38.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.029 |
32 |
|
[MG]B:605 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
21716 |
37.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.029 |
33 |
|
[MG]A:606 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
21607 |
33.1 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.029 |
Average: |
36.3 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.029 |
27 |
34 |
|
[OXL]A:607 |
5 |
1 |
198 |
f |
[K]A:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
34.5 |
-16.3 |
0.000 |
0 |
0 |
0 |
0.103 |
35 |
|
[OXL]C:605 |
3 |
1 |
200 |
f |
[K]C:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
24.6 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.103 |
Average: |
29.5 |
-14.0 |
0.000 |
0 |
0 |
0 |
0.103 |
28 |
36 |
|
C |
4 |
1 |
20952 |
◊ |
D |
x,y,z-1 |
1_554 |
3 |
2 |
17455 |
31.0 |
-0.1 |
0.447 |
0 |
0 |
0 |
0.000 |
37 |
|
A |
3 |
1 |
21607 |
◊ |
B |
x,y,z-1 |
1_554 |
1 |
1 |
21716 |
27.9 |
-0.5 |
0.198 |
0 |
0 |
0 |
0.000 |
Average: |
29.5 |
-0.3 |
0.322 |
0 |
0 |
0 |
0.001 |
29 |
38 |
|
[OXL]B:606 |
4 |
1 |
198 |
f |
[MG]B:605 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.0 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.012 |
30 |
39 |
|
[OXL]C:605 |
4 |
1 |
200 |
f |
[MG]C:604 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.7 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.022 |
40 |
|
[OXL]A:607 |
4 |
1 |
198 |
f |
[MG]A:606 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.7 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.022 |
Average: |
28.2 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.022 |
31 |
41 |
|
[GOL]A:604 |
3 |
1 |
220 |
f |
[GOL]A:603 |
x,y,z |
1_555 |
2 |
1 |
219 |
24.9 |
0.4 |
0.750 |
1 |
0 |
0 |
0.000 |
32 |
42 |
|
[OXL]B:606 |
3 |
1 |
198 |
f |
[K]B:602 |
x,y,z |
1_555 |
1 |
1 |
216 |
21.9 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.036 |
33 |
43 |
|
[FBP]A:608 |
2 |
1 |
205 |
f |
[GOL]A:605 |
x,y,z |
1_555 |
4 |
1 |
222 |
20.8 |
0.3 |
0.446 |
1 |
0 |
0 |
0.001 |
34 |
44 |
|
[MG]A:606 |
1 |
1 |
98 |
f |
[K]A:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
20.4 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.079 |
35 |
45 |
|
D |
3 |
3 |
17455 |
◊ |
C |
x-1,y,z |
1_455 |
4 |
3 |
20952 |
19.4 |
-0.3 |
0.507 |
0 |
0 |
0 |
0.000 |
36 |
46 |
|
[MG]C:604 |
1 |
1 |
98 |
f |
[K]C:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
18.4 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.037 |
37 |
47 |
|
[GOL]A:605 |
2 |
1 |
222 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
20952 |
15.7 |
-0.3 |
0.288 |
0 |
0 |
0 |
0.000 |
38 |
48 |
|
B |
3 |
2 |
21716 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
2 |
1 |
21607 |
13.9 |
-0.4 |
0.349 |
0 |
0 |
0 |
0.000 |
39 |
49 |
|
[MG]B:605 |
1 |
1 |
98 |
f |
[K]B:602 |
x,y,z |
1_555 |
1 |
1 |
216 |
12.1 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.028 |
40 |
50 |
|
[K]B:602 |
1 |
1 |
216 |
f |
[K]B:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
11.1 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.040 |
41 |
51 |
|
[GOL]A:602 |
3 |
1 |
217 |
f |
[K]A:601 |
x,y,z |
1_555 |
1 |
1 |
216 |
10.2 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.028 |
|