## |
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 |
242 |
67 |
15070 |
◊ |
A |
x,y,z |
1_555 |
245 |
68 |
15443 |
2344.6 |
-31.6 |
0.028 |
25 |
2 |
0 |
0.894 |
2 |
|
D |
235 |
66 |
15407 |
◊ |
C |
x,y,z |
1_555 |
237 |
64 |
15185 |
2313.6 |
-30.8 |
0.024 |
22 |
2 |
0 |
0.894 |
3 |
|
F |
237 |
66 |
15099 |
◊ |
E |
x,y,z |
1_555 |
237 |
66 |
15426 |
2296.7 |
-30.4 |
0.028 |
23 |
2 |
0 |
0.894 |
4 |
|
H |
236 |
67 |
15240 |
◊ |
G |
x,y,z |
1_555 |
234 |
66 |
15182 |
2296.1 |
-31.3 |
0.023 |
22 |
2 |
0 |
0.894 |
Average: |
2312.8 |
-31.0 |
0.026 |
23 |
2 |
0 |
0.894 |
2 |
5 |
|
H |
113 |
33 |
15240 |
◊ |
F |
x,y,z |
1_555 |
120 |
35 |
15099 |
1202.4 |
-1.7 |
0.649 |
20 |
9 |
0 |
0.636 |
6 |
|
G |
112 |
34 |
15182 |
◊ |
E |
x,y,z |
1_555 |
108 |
33 |
15426 |
1165.1 |
-4.2 |
0.499 |
17 |
6 |
0 |
0.636 |
7 |
|
C |
106 |
33 |
15185 |
◊ |
A |
x,y,z |
1_555 |
106 |
33 |
15443 |
1149.2 |
-3.6 |
0.524 |
16 |
5 |
0 |
0.636 |
8 |
|
D |
110 |
32 |
15407 |
◊ |
B |
x,y,z |
1_555 |
107 |
33 |
15070 |
1143.6 |
-2.1 |
0.599 |
17 |
6 |
0 |
0.636 |
Average: |
1165.1 |
-2.9 |
0.568 |
18 |
7 |
0 |
0.636 |
3 |
9 |
|
D |
54 |
17 |
15407 |
◊ |
G |
-x+1,y-1/2,-z+1 |
2_646 |
47 |
15 |
15182 |
459.0 |
0.7 |
0.706 |
8 |
10 |
0 |
0.000 |
10 |
|
C |
44 |
13 |
15185 |
◊ |
H |
-x+1,y-1/2,-z |
2_645 |
56 |
18 |
15240 |
451.7 |
2.6 |
0.774 |
9 |
12 |
0 |
0.000 |
Average: |
455.4 |
1.7 |
0.740 |
9 |
11 |
0 |
0.000 |
4 |
11 |
|
G |
42 |
15 |
15182 |
◊ |
F |
x,y,z |
1_555 |
41 |
15 |
15099 |
420.9 |
-7.6 |
0.080 |
4 |
0 |
0 |
0.137 |
12 |
|
H |
40 |
14 |
15240 |
◊ |
E |
x,y,z |
1_555 |
39 |
15 |
15426 |
416.2 |
-7.0 |
0.086 |
4 |
0 |
0 |
0.137 |
13 |
|
D |
40 |
14 |
15407 |
◊ |
A |
x,y,z |
1_555 |
40 |
14 |
15443 |
408.8 |
-7.7 |
0.062 |
4 |
0 |
0 |
0.137 |
14 |
|
C |
37 |
14 |
15185 |
◊ |
B |
x,y,z |
1_555 |
41 |
14 |
15070 |
407.5 |
-7.9 |
0.052 |
4 |
0 |
0 |
0.137 |
Average: |
413.4 |
-7.5 |
0.070 |
4 |
0 |
0 |
0.137 |
5 |
15 |
|
F |
40 |
10 |
15099 |
◊ |
A |
x-1,y,z |
1_455 |
42 |
14 |
15443 |
406.1 |
-1.6 |
0.492 |
3 |
4 |
0 |
0.000 |
6 |
16 |
|
A |
46 |
15 |
15443 |
◊ |
E |
x,y,z-1 |
1_554 |
34 |
9 |
15426 |
381.5 |
-1.9 |
0.524 |
3 |
0 |
0 |
0.000 |
7 |
17 |
|
[RO5]C:1337 |
21 |
1 |
527 |
f |
C |
x,y,z |
1_555 |
48 |
17 |
15185 |
311.9 |
0.4 |
0.299 |
7 |
0 |
0 |
0.283 |
18 |
|
[RO5]G:1337 |
21 |
1 |
527 |
f |
G |
x,y,z |
1_555 |
51 |
17 |
15182 |
306.9 |
0.3 |
0.302 |
6 |
0 |
0 |
0.283 |
19 |
|
[RO5]F:1337 |
21 |
1 |
529 |
f |
F |
x,y,z |
1_555 |
49 |
17 |
15099 |
306.7 |
0.3 |
0.306 |
7 |
0 |
0 |
0.283 |
20 |
|
[RO5]H:1337 |
21 |
1 |
525 |
f |
H |
x,y,z |
1_555 |
51 |
17 |
15240 |
305.9 |
0.1 |
0.273 |
6 |
0 |
0 |
0.283 |
21 |
|
[RO5]D:1337 |
21 |
1 |
523 |
f |
D |
x,y,z |
1_555 |
49 |
17 |
15407 |
304.8 |
0.1 |
0.276 |
6 |
0 |
0 |
0.283 |
22 |
|
[RO5]E:1337 |
21 |
1 |
527 |
f |
E |
x,y,z |
1_555 |
45 |
17 |
15426 |
302.9 |
0.1 |
0.265 |
6 |
0 |
0 |
0.283 |
23 |
|
[RO5]A:1337 |
21 |
1 |
525 |
f |
A |
x,y,z |
1_555 |
50 |
17 |
15443 |
302.4 |
0.4 |
0.312 |
7 |
0 |
0 |
0.283 |
24 |
|
[RO5]B:1337 |
21 |
1 |
527 |
f |
B |
x,y,z |
1_555 |
45 |
15 |
15070 |
302.3 |
0.3 |
0.282 |
6 |
0 |
0 |
0.283 |
Average: |
305.5 |
0.3 |
0.289 |
6 |
0 |
0 |
0.283 |
8 |
25 |
|
F |
31 |
11 |
15099 |
◊ |
H |
x-1,y,z |
1_455 |
32 |
10 |
15240 |
279.9 |
1.9 |
0.811 |
2 |
3 |
0 |
0.000 |
9 |
26 |
|
B |
34 |
11 |
15070 |
◊ |
D |
x-1,y,z |
1_455 |
30 |
12 |
15407 |
278.0 |
5.1 |
0.943 |
6 |
10 |
0 |
0.000 |
10 |
27 |
|
C |
29 |
6 |
15185 |
◊ |
D |
x,y,z-1 |
1_554 |
26 |
6 |
15407 |
223.4 |
0.0 |
0.641 |
8 |
1 |
0 |
0.000 |
28 |
|
H |
26 |
6 |
15240 |
◊ |
G |
x,y,z-1 |
1_554 |
22 |
6 |
15182 |
198.8 |
-0.7 |
0.587 |
7 |
1 |
0 |
0.000 |
Average: |
211.1 |
-0.3 |
0.614 |
8 |
1 |
0 |
0.000 |
11 |
29 |
|
[RO5]H:1337 |
4 |
1 |
525 |
◊ |
F |
x,y,z |
1_555 |
12 |
5 |
15099 |
75.3 |
-0.8 |
0.283 |
0 |
0 |
0 |
0.072 |
30 |
|
[RO5]E:1337 |
4 |
1 |
527 |
◊ |
G |
x,y,z |
1_555 |
12 |
6 |
15182 |
71.9 |
-0.7 |
0.309 |
0 |
0 |
0 |
0.072 |
31 |
|
[RO5]F:1337 |
4 |
1 |
529 |
◊ |
H |
x,y,z |
1_555 |
12 |
6 |
15240 |
70.5 |
-0.6 |
0.311 |
0 |
0 |
0 |
0.072 |
32 |
|
[RO5]B:1337 |
4 |
1 |
527 |
◊ |
D |
x,y,z |
1_555 |
12 |
6 |
15407 |
69.7 |
-0.9 |
0.280 |
0 |
0 |
0 |
0.072 |
33 |
|
[RO5]A:1337 |
4 |
1 |
525 |
◊ |
C |
x,y,z |
1_555 |
12 |
6 |
15185 |
69.1 |
-0.7 |
0.303 |
0 |
0 |
0 |
0.072 |
34 |
|
[RO5]D:1337 |
4 |
1 |
523 |
◊ |
B |
x,y,z |
1_555 |
13 |
6 |
15070 |
68.7 |
-0.8 |
0.288 |
0 |
0 |
0 |
0.072 |
35 |
|
[RO5]C:1337 |
3 |
1 |
527 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
15443 |
68.3 |
-0.6 |
0.308 |
0 |
0 |
0 |
0.072 |
36 |
|
[RO5]G:1337 |
3 |
1 |
527 |
◊ |
E |
x,y,z |
1_555 |
13 |
6 |
15426 |
66.9 |
-0.7 |
0.301 |
0 |
0 |
0 |
0.072 |
Average: |
70.1 |
-0.7 |
0.298 |
0 |
0 |
0 |
0.072 |
12 |
37 |
|
A |
8 |
4 |
15443 |
x |
A |
x-1,y,z |
1_455 |
6 |
3 |
15443 |
71.7 |
-0.8 |
0.429 |
0 |
0 |
0 |
0.000 |
13 |
38 |
|
[RO5]G:1337 |
9 |
1 |
527 |
◊ |
[RO5]E:1337 |
x,y,z |
1_555 |
9 |
1 |
527 |
64.1 |
-1.0 |
0.128 |
0 |
0 |
0 |
0.048 |
39 |
|
[RO5]C:1337 |
9 |
1 |
527 |
◊ |
[RO5]A:1337 |
x,y,z |
1_555 |
9 |
1 |
525 |
62.8 |
-0.9 |
0.134 |
0 |
0 |
0 |
0.048 |
40 |
|
[RO5]D:1337 |
9 |
1 |
523 |
◊ |
[RO5]B:1337 |
x,y,z |
1_555 |
9 |
1 |
527 |
62.8 |
-0.9 |
0.138 |
0 |
0 |
0 |
0.048 |
41 |
|
[RO5]H:1337 |
9 |
1 |
525 |
◊ |
[RO5]F:1337 |
x,y,z |
1_555 |
9 |
1 |
529 |
60.5 |
-0.9 |
0.132 |
0 |
0 |
0 |
0.048 |
Average: |
62.5 |
-0.9 |
0.133 |
0 |
0 |
0 |
0.048 |
14 |
42 |
|
F |
8 |
4 |
15099 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
15070 |
54.4 |
-0.6 |
0.490 |
0 |
0 |
0 |
0.000 |
15 |
43 |
|
E |
5 |
3 |
15426 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
15070 |
38.0 |
-0.7 |
0.427 |
0 |
0 |
0 |
0.000 |
16 |
44 |
|
B |
6 |
3 |
15070 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
3 |
15185 |
21.9 |
0.3 |
0.697 |
0 |
0 |
0 |
0.000 |
17 |
45 |
|
D |
1 |
1 |
15407 |
◊ |
H |
-x+1,y-1/2,-z |
2_645 |
2 |
1 |
15240 |
18.2 |
-0.1 |
0.475 |
0 |
0 |
0 |
0.000 |
46 |
|
D |
1 |
1 |
15407 |
◊ |
H |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
1 |
15240 |
7.7 |
-0.1 |
0.403 |
0 |
0 |
0 |
0.000 |
Average: |
13.0 |
-0.1 |
0.439 |
0 |
0 |
0 |
0.000 |
|