## |
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 |
99 |
24 |
9531 |
◊ |
D |
y,x,-z |
7_555 |
100 |
25 |
9531 |
909.5 |
-8.1 |
0.330 |
10 |
12 |
0 |
0.358 |
2 |
|
A |
98 |
23 |
9269 |
◊ |
A |
y+1,x-1,-z |
7_645 |
97 |
23 |
9269 |
889.5 |
-7.9 |
0.357 |
12 |
10 |
0 |
0.358 |
3 |
|
C |
96 |
24 |
9565 |
◊ |
B |
x,y,z |
1_555 |
98 |
22 |
8630 |
873.6 |
-12.6 |
0.117 |
7 |
1 |
0 |
0.358 |
Average: |
890.9 |
-9.5 |
0.268 |
10 |
8 |
0 |
0.358 |
2 |
4 |
|
D |
49 |
15 |
9531 |
◊ |
A |
-y-1/2,x-1/2,z-1/4 |
3_444 |
47 |
15 |
9269 |
442.9 |
-4.2 |
0.369 |
2 |
0 |
0 |
0.000 |
3 |
5 |
|
B |
40 |
11 |
8630 |
◊ |
A |
x,y,z |
1_555 |
45 |
13 |
9269 |
360.8 |
-4.6 |
0.281 |
3 |
1 |
0 |
0.000 |
6 |
|
D |
34 |
10 |
9531 |
◊ |
C |
x,y,z |
1_555 |
42 |
12 |
9565 |
340.0 |
-1.7 |
0.563 |
3 |
3 |
0 |
0.000 |
Average: |
350.4 |
-3.2 |
0.422 |
3 |
2 |
0 |
0.000 |
4 |
7 |
|
A |
47 |
13 |
9269 |
◊ |
C |
-y+1/2,x-1/2,z+3/4 |
3_545 |
47 |
15 |
9565 |
359.6 |
-0.9 |
0.660 |
0 |
2 |
0 |
0.000 |
5 |
8 |
|
B |
33 |
9 |
8630 |
◊ |
A |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
38 |
12 |
9269 |
337.7 |
-0.1 |
0.678 |
5 |
1 |
0 |
0.000 |
6 |
9 |
|
C |
28 |
11 |
9565 |
◊ |
B |
-y+1/2,x-1/2,z-1/4 |
3_544 |
30 |
11 |
8630 |
276.5 |
-2.2 |
0.441 |
3 |
0 |
0 |
0.000 |
7 |
10 |
|
A |
20 |
9 |
9269 |
◊ |
D |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
23 |
6 |
9531 |
199.4 |
-3.4 |
0.223 |
0 |
0 |
0 |
0.000 |
8 |
11 |
|
B |
14 |
5 |
8630 |
◊ |
D |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
21 |
7 |
9531 |
130.0 |
2.2 |
0.875 |
1 |
1 |
0 |
0.000 |
9 |
12 |
|
[GOL]D:1251 |
6 |
1 |
218 |
f |
D |
x,y,z |
1_555 |
20 |
8 |
9531 |
99.3 |
-1.4 |
0.413 |
0 |
0 |
0 |
0.065 |
10 |
13 |
|
[DMS]B:1253 |
4 |
1 |
215 |
◊ |
C |
x,y,z |
1_555 |
16 |
6 |
9565 |
98.0 |
1.9 |
0.439 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
[GOL]B:1251 |
6 |
1 |
219 |
f |
C |
x,y,z |
1_555 |
20 |
8 |
9565 |
97.5 |
-1.0 |
0.459 |
1 |
0 |
0 |
0.025 |
12 |
15 |
|
D |
10 |
4 |
9531 |
◊ |
D |
-y,-x,-z-1/2 |
8_554 |
10 |
4 |
9531 |
97.0 |
-3.7 |
0.039 |
0 |
0 |
0 |
0.000 |
13 |
16 |
|
[GOL]C:1251 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
8630 |
95.9 |
-1.2 |
0.430 |
1 |
0 |
0 |
0.029 |
14 |
17 |
|
[GOL]A:1251 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
9269 |
95.7 |
-1.3 |
0.429 |
1 |
0 |
0 |
0.083 |
15 |
18 |
|
[DMS]B:1252 |
4 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
8630 |
91.4 |
1.9 |
0.288 |
0 |
0 |
0 |
0.000 |
16 |
19 |
|
[DMS]B:1252 |
4 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
9269 |
90.5 |
1.1 |
0.372 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
[SO4]A:1252 |
5 |
1 |
187 |
f |
C |
-y+1/2,x-1/2,z+3/4 |
3_545 |
12 |
6 |
9565 |
86.2 |
-12.2 |
0.900 |
3 |
0 |
0 |
0.241 |
18 |
21 |
|
[GOL]D:1251 |
6 |
1 |
218 |
◊ |
D |
y,x,-z |
7_555 |
10 |
4 |
9531 |
76.2 |
0.6 |
0.733 |
3 |
0 |
0 |
0.032 |
19 |
22 |
|
[CL]C:1250 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
14 |
8 |
9565 |
76.1 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.592 |
23 |
|
[CL]B:1250 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
8630 |
75.7 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.592 |
24 |
|
[CL]A:1250 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
9269 |
75.5 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.592 |
25 |
|
[CL]D:1250 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
16 |
9 |
9531 |
73.7 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.592 |
Average: |
75.3 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.592 |
20 |
26 |
|
[GOL]A:1251 |
6 |
1 |
218 |
◊ |
A |
y+1,x-1,-z |
7_645 |
10 |
4 |
9269 |
72.9 |
0.0 |
0.566 |
1 |
0 |
0 |
0.019 |
21 |
27 |
|
C |
7 |
2 |
9565 |
◊ |
D |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
10 |
4 |
9531 |
72.6 |
1.1 |
0.816 |
1 |
0 |
0 |
0.000 |
22 |
28 |
|
[GOL]C:1251 |
5 |
1 |
219 |
◊ |
C |
x,y,z |
1_555 |
10 |
4 |
9565 |
71.1 |
0.0 |
0.550 |
1 |
0 |
0 |
0.008 |
23 |
29 |
|
[GOL]B:1251 |
5 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
8630 |
71.0 |
-0.1 |
0.547 |
1 |
0 |
0 |
0.011 |
24 |
30 |
|
[SO4]A:1252 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
9269 |
65.6 |
-7.3 |
0.899 |
1 |
0 |
0 |
0.000 |
25 |
31 |
|
A |
11 |
3 |
9269 |
◊ |
B |
-y+1/2,x-1/2,z-1/4 |
3_544 |
8 |
3 |
8630 |
56.9 |
-0.3 |
0.586 |
0 |
0 |
0 |
0.000 |
26 |
32 |
|
A |
5 |
2 |
9269 |
◊ |
D |
-y+1/2,x-1/2,z+3/4 |
3_545 |
4 |
1 |
9531 |
47.5 |
-1.0 |
0.270 |
0 |
0 |
0 |
0.000 |
33 |
|
B |
3 |
1 |
8630 |
◊ |
C |
-y+1/2,x-1/2,z+3/4 |
3_545 |
5 |
2 |
9565 |
36.0 |
-0.8 |
0.307 |
0 |
0 |
0 |
0.000 |
Average: |
41.8 |
-0.9 |
0.289 |
0 |
0 |
0 |
0.000 |
27 |
34 |
|
[DMS]B:1253 |
3 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
8630 |
41.2 |
0.4 |
0.358 |
0 |
0 |
0 |
0.000 |
28 |
35 |
|
D |
3 |
1 |
9531 |
◊ |
A |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
8 |
4 |
9269 |
36.9 |
0.3 |
0.719 |
0 |
0 |
0 |
0.000 |
29 |
36 |
|
[GOL]C:1251 |
4 |
1 |
219 |
◊ |
[GOL]B:1251 |
x,y,z |
1_555 |
4 |
1 |
219 |
31.5 |
-0.1 |
0.556 |
1 |
0 |
0 |
0.009 |
30 |
37 |
|
[DMS]B:1253 |
3 |
1 |
215 |
◊ |
D |
-x+1/2,y-1/2,-z-1/4 |
5_544 |
3 |
1 |
9531 |
31.0 |
0.5 |
0.223 |
0 |
0 |
0 |
0.000 |
31 |
38 |
|
[GOL]A:1251 |
4 |
1 |
218 |
◊ |
[GOL]A:1251 |
y+1,x-1,-z |
7_645 |
4 |
1 |
218 |
30.9 |
-0.0 |
0.646 |
0 |
0 |
0 |
0.000 |
32 |
39 |
|
[GOL]D:1251 |
3 |
1 |
218 |
◊ |
[GOL]D:1251 |
y,x,-z |
7_555 |
2 |
1 |
218 |
29.1 |
-0.9 |
0.278 |
0 |
0 |
0 |
0.021 |
33 |
40 |
|
C |
6 |
2 |
9565 |
◊ |
A |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
3 |
2 |
9269 |
18.0 |
0.5 |
0.774 |
0 |
0 |
0 |
0.000 |
34 |
41 |
|
C |
1 |
1 |
9565 |
◊ |
D |
-y+1/2,x-1/2,z-1/4 |
3_544 |
3 |
2 |
9531 |
11.2 |
0.3 |
0.781 |
0 |
0 |
0 |
0.000 |
35 |
42 |
|
D |
2 |
2 |
9531 |
◊ |
A |
-x+1,-y,z-1/2 |
2_654 |
2 |
2 |
9269 |
6.2 |
0.2 |
0.751 |
0 |
0 |
0 |
0.000 |
36 |
43 |
|
B |
3 |
1 |
8630 |
x |
B |
-y+1/2,x-1/2,z-1/4 |
3_544 |
1 |
1 |
8630 |
4.7 |
-0.1 |
0.463 |
0 |
0 |
0 |
0.000 |
|