## |
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 |
|
G |
297 |
74 |
17140 |
◊ |
F |
x,y,z |
1_555 |
293 |
73 |
17129 |
2996.2 |
-27.5 |
0.070 |
37 |
14 |
0 |
1.000 |
2 |
|
H |
296 |
75 |
16984 |
◊ |
E |
x,y,z |
1_555 |
294 |
74 |
16642 |
2980.4 |
-26.4 |
0.074 |
38 |
14 |
0 |
1.000 |
Average: |
2988.3 |
-27.0 |
0.072 |
38 |
14 |
0 |
1.000 |
2 |
3 |
|
F |
144 |
36 |
17129 |
◊ |
A |
x,y,z |
1_555 |
157 |
48 |
28139 |
1392.9 |
-19.9 |
0.013 |
9 |
0 |
0 |
0.507 |
4 |
|
H |
133 |
34 |
16984 |
◊ |
B |
x,y,z |
1_555 |
150 |
45 |
28327 |
1377.8 |
-21.5 |
0.005 |
12 |
2 |
0 |
0.507 |
5 |
|
E |
125 |
30 |
16642 |
◊ |
C |
x,y,z |
1_555 |
130 |
41 |
28017 |
1218.8 |
-15.2 |
0.036 |
7 |
2 |
0 |
0.507 |
Average: |
1329.9 |
-18.8 |
0.018 |
9 |
1 |
0 |
0.507 |
3 |
6 |
|
G |
135 |
33 |
17140 |
◊ |
D |
x,y,z |
1_555 |
149 |
45 |
28176 |
1348.2 |
-17.6 |
0.027 |
10 |
1 |
0 |
0.421 |
4 |
7 |
|
D |
135 |
45 |
28176 |
◊ |
C |
x,y,z |
1_555 |
134 |
43 |
28017 |
1282.6 |
-8.6 |
0.194 |
12 |
6 |
0 |
0.158 |
8 |
|
B |
146 |
47 |
28327 |
◊ |
A |
x,y,z |
1_555 |
144 |
45 |
28139 |
1269.3 |
-9.7 |
0.154 |
11 |
4 |
0 |
0.158 |
Average: |
1275.9 |
-9.1 |
0.174 |
12 |
5 |
0 |
0.158 |
5 |
9 |
|
B |
44 |
17 |
28327 |
◊ |
G |
x-1/2,y-1/2,z |
3_445 |
47 |
13 |
17140 |
427.7 |
4.2 |
0.910 |
3 |
4 |
0 |
0.000 |
6 |
10 |
|
[DTP]A:801 |
29 |
1 |
567 |
f |
A |
x,y,z |
1_555 |
54 |
20 |
28139 |
392.0 |
-1.6 |
0.403 |
8 |
0 |
0 |
0.116 |
11 |
|
[DTP]B:801 |
28 |
1 |
569 |
f |
B |
x,y,z |
1_555 |
56 |
21 |
28327 |
385.9 |
0.0 |
0.479 |
7 |
0 |
0 |
0.116 |
12 |
|
[DTP]D:801 |
29 |
1 |
564 |
f |
D |
x,y,z |
1_555 |
50 |
16 |
28176 |
373.8 |
-0.8 |
0.484 |
12 |
0 |
0 |
0.116 |
13 |
|
[DTP]C:801 |
29 |
1 |
567 |
f |
C |
x,y,z |
1_555 |
50 |
17 |
28017 |
371.4 |
-0.3 |
0.520 |
10 |
0 |
0 |
0.116 |
Average: |
380.8 |
-0.7 |
0.472 |
9 |
0 |
0 |
0.116 |
7 |
14 |
|
A |
46 |
15 |
28139 |
◊ |
F |
-x+1/2,y-1/2,-z+1 |
4_546 |
43 |
14 |
17129 |
387.3 |
-1.2 |
0.444 |
3 |
1 |
0 |
0.000 |
8 |
15 |
|
[DTP]D:803 |
29 |
1 |
582 |
f |
D |
x,y,z |
1_555 |
39 |
15 |
28176 |
342.0 |
-1.0 |
0.367 |
4 |
0 |
0 |
0.075 |
16 |
|
[DTP]A:803 |
30 |
1 |
594 |
f |
A |
x,y,z |
1_555 |
43 |
14 |
28139 |
339.5 |
-0.5 |
0.395 |
6 |
0 |
0 |
0.075 |
17 |
|
[DTP]B:803 |
29 |
1 |
580 |
f |
B |
x,y,z |
1_555 |
39 |
13 |
28327 |
333.3 |
-0.9 |
0.369 |
7 |
0 |
0 |
0.075 |
Average: |
338.2 |
-0.8 |
0.377 |
6 |
0 |
0 |
0.075 |
9 |
18 |
|
[DTP]C:803 |
30 |
1 |
580 |
f |
C |
x,y,z |
1_555 |
42 |
16 |
28017 |
341.9 |
-0.9 |
0.389 |
4 |
0 |
0 |
0.059 |
10 |
19 |
|
[DAT]A:802 |
24 |
1 |
540 |
f |
A |
x,y,z |
1_555 |
46 |
22 |
28139 |
330.2 |
-7.0 |
0.196 |
9 |
0 |
0 |
0.258 |
20 |
|
[DAT]C:802 |
26 |
1 |
549 |
f |
C |
x,y,z |
1_555 |
49 |
23 |
28017 |
323.4 |
-7.4 |
0.264 |
10 |
0 |
0 |
0.258 |
Average: |
326.8 |
-7.2 |
0.230 |
10 |
0 |
0 |
0.258 |
11 |
21 |
|
[DAT]B:802 |
25 |
1 |
546 |
f |
B |
x,y,z |
1_555 |
48 |
23 |
28327 |
326.7 |
-6.9 |
0.218 |
8 |
0 |
0 |
0.196 |
12 |
22 |
|
H |
38 |
12 |
16984 |
◊ |
A |
-x,y,-z |
2_555 |
29 |
13 |
28139 |
305.6 |
2.7 |
0.857 |
5 |
1 |
0 |
0.000 |
13 |
23 |
|
[DAT]D:802 |
22 |
1 |
505 |
f |
D |
x,y,z |
1_555 |
41 |
21 |
28176 |
288.1 |
-7.6 |
0.201 |
10 |
0 |
0 |
0.229 |
14 |
24 |
|
B |
19 |
8 |
28327 |
◊ |
G |
-x+1/2,y-1/2,-z+1 |
4_546 |
23 |
10 |
17140 |
146.4 |
-1.5 |
0.403 |
0 |
0 |
0 |
0.000 |
15 |
25 |
|
F |
18 |
6 |
17129 |
◊ |
F |
-x+1,y,-z+1 |
2_656 |
19 |
6 |
17129 |
138.4 |
-1.5 |
0.413 |
2 |
0 |
0 |
0.000 |
16 |
26 |
|
F |
17 |
6 |
17129 |
◊ |
E |
-x,y,-z |
2_555 |
13 |
5 |
16642 |
134.9 |
-1.1 |
0.435 |
1 |
0 |
0 |
0.000 |
17 |
27 |
|
B |
19 |
6 |
28327 |
◊ |
A |
-x,y,-z |
2_555 |
25 |
11 |
28139 |
126.6 |
1.7 |
0.777 |
1 |
0 |
0 |
0.000 |
18 |
28 |
|
E |
14 |
5 |
16642 |
◊ |
A |
x-1/2,y+1/2,z-1 |
3_454 |
12 |
4 |
28139 |
121.1 |
0.4 |
0.537 |
0 |
0 |
0 |
0.000 |
19 |
29 |
|
F |
13 |
5 |
17129 |
◊ |
C |
-x+1/2,y-1/2,-z |
4_545 |
11 |
5 |
28017 |
114.0 |
-0.8 |
0.433 |
1 |
0 |
0 |
0.000 |
20 |
30 |
|
A |
14 |
5 |
28139 |
◊ |
D |
x,y-1,z |
1_545 |
18 |
7 |
28176 |
105.4 |
-1.9 |
0.245 |
0 |
0 |
0 |
0.000 |
21 |
31 |
|
H |
11 |
4 |
16984 |
◊ |
B |
-x,y,-z |
2_555 |
12 |
3 |
28327 |
104.7 |
1.0 |
0.743 |
2 |
3 |
0 |
0.000 |
22 |
32 |
|
E |
10 |
2 |
16642 |
◊ |
D |
-x,y,-z |
2_555 |
9 |
2 |
28176 |
99.3 |
1.3 |
0.805 |
1 |
2 |
0 |
0.000 |
23 |
33 |
|
[DTP]C:803 |
9 |
1 |
580 |
◊ |
D |
x,y,z |
1_555 |
12 |
4 |
28176 |
83.0 |
1.1 |
0.440 |
1 |
0 |
0 |
0.000 |
24 |
34 |
|
[DTP]A:803 |
7 |
1 |
594 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
28327 |
80.4 |
1.0 |
0.457 |
2 |
0 |
0 |
0.000 |
35 |
|
[DTP]B:803 |
8 |
1 |
580 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
28139 |
75.8 |
0.5 |
0.292 |
1 |
0 |
0 |
0.000 |
36 |
|
[DTP]D:803 |
8 |
1 |
582 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
28017 |
75.0 |
0.8 |
0.313 |
1 |
0 |
0 |
0.000 |
Average: |
77.0 |
0.8 |
0.354 |
1 |
0 |
0 |
0.000 |
25 |
37 |
|
H |
12 |
6 |
16984 |
◊ |
F |
-x,y,-z |
2_555 |
10 |
4 |
17129 |
74.7 |
0.1 |
0.576 |
0 |
0 |
0 |
0.000 |
26 |
38 |
|
[MG]D:804 |
1 |
1 |
98 |
f |
[DTP]D:803 |
x,y,z |
1_555 |
6 |
1 |
582 |
44.2 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.130 |
39 |
|
[MG]A:804 |
1 |
1 |
98 |
f |
[DTP]A:803 |
x,y,z |
1_555 |
5 |
1 |
594 |
43.9 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.130 |
40 |
|
[MG]C:804 |
1 |
1 |
98 |
f |
[DTP]C:803 |
x,y,z |
1_555 |
8 |
1 |
580 |
43.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.130 |
41 |
|
[MG]B:804 |
1 |
1 |
98 |
f |
[DTP]B:803 |
x,y,z |
1_555 |
5 |
1 |
580 |
43.5 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.130 |
Average: |
43.8 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.130 |
27 |
42 |
|
A |
5 |
2 |
28139 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
5 |
2 |
28139 |
36.3 |
-0.3 |
0.455 |
0 |
0 |
0 |
0.000 |
28 |
43 |
|
G |
7 |
3 |
17140 |
◊ |
E |
-x,y,-z |
2_555 |
3 |
1 |
16642 |
34.4 |
0.4 |
0.726 |
0 |
0 |
0 |
0.000 |
29 |
44 |
|
F |
3 |
1 |
17129 |
◊ |
D |
x,y-1,z |
1_545 |
6 |
2 |
28176 |
34.0 |
0.6 |
0.770 |
1 |
0 |
0 |
0.000 |
30 |
45 |
|
[MG]D:804 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
5 |
3 |
28176 |
32.2 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.060 |
46 |
|
[MG]B:804 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
3 |
3 |
28327 |
26.9 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.060 |
47 |
|
[MG]A:804 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
28139 |
24.9 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.060 |
48 |
|
[MG]C:804 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
4 |
3 |
28017 |
23.8 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.060 |
Average: |
26.9 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.060 |
31 |
49 |
|
G |
4 |
2 |
17140 |
◊ |
F |
-x+1,y,-z+1 |
2_656 |
4 |
2 |
17129 |
31.1 |
-0.8 |
0.279 |
0 |
0 |
0 |
0.000 |
32 |
50 |
|
E |
4 |
3 |
16642 |
◊ |
B |
-x,y,-z |
2_555 |
1 |
1 |
28327 |
23.4 |
1.2 |
0.879 |
0 |
0 |
0 |
0.000 |
33 |
51 |
|
G |
6 |
4 |
17140 |
◊ |
G |
-x+1,y,-z+1 |
2_656 |
6 |
4 |
17140 |
20.1 |
0.6 |
0.775 |
0 |
0 |
0 |
0.000 |
34 |
52 |
|
A |
2 |
2 |
28139 |
◊ |
G |
x,y-1,z |
1_545 |
1 |
1 |
17140 |
17.5 |
0.4 |
0.852 |
0 |
0 |
0 |
0.000 |
35 |
53 |
|
B |
2 |
1 |
28327 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
4 |
1 |
28176 |
10.5 |
-0.1 |
0.445 |
0 |
0 |
0 |
0.000 |
36 |
54 |
|
A |
3 |
1 |
28139 |
◊ |
G |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
17140 |
7.3 |
0.3 |
0.746 |
0 |
0 |
0 |
0.000 |
37 |
55 |
|
D |
1 |
1 |
28176 |
◊ |
C |
-x,y,-z |
2_555 |
1 |
1 |
28017 |
4.3 |
0.1 |
0.804 |
0 |
0 |
0 |
0.000 |
38 |
56 |
|
G |
1 |
1 |
17140 |
◊ |
C |
-x,y,-z |
2_555 |
2 |
1 |
28017 |
3.4 |
-0.1 |
0.440 |
0 |
0 |
0 |
0.000 |
|