## |
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 |
385 |
97 |
14391 |
◊ |
C |
x,y,z |
1_555 |
323 |
68 |
8214 |
3481.6 |
-46.2 |
0.168 |
32 |
7 |
0 |
1.000 |
2 |
|
B |
391 |
99 |
14341 |
◊ |
A |
x,y,z |
1_555 |
324 |
66 |
7775 |
3449.5 |
-46.3 |
0.238 |
37 |
8 |
0 |
1.000 |
Average: |
3465.5 |
-46.3 |
0.203 |
35 |
8 |
0 |
1.000 |
2 |
3 |
|
F |
113 |
29 |
14386 |
◊ |
B |
x,y,z |
1_555 |
126 |
33 |
14341 |
1042.9 |
-7.6 |
0.452 |
13 |
7 |
0 |
1.000 |
4 |
|
E |
111 |
29 |
14699 |
◊ |
D |
x,y,z |
1_555 |
116 |
32 |
14391 |
1036.9 |
-6.7 |
0.522 |
13 |
11 |
0 |
1.000 |
Average: |
1039.9 |
-7.2 |
0.487 |
13 |
9 |
0 |
1.000 |
3 |
5 |
|
F |
72 |
11 |
14386 |
◊ |
E |
x,y,z |
1_555 |
74 |
12 |
14699 |
651.4 |
-5.3 |
0.340 |
9 |
0 |
0 |
0.448 |
4 |
6 |
|
F |
73 |
23 |
14386 |
◊ |
A |
x,y,z |
1_555 |
57 |
13 |
7775 |
639.7 |
-16.3 |
0.024 |
1 |
0 |
0 |
1.000 |
7 |
|
E |
69 |
22 |
14699 |
◊ |
C |
x,y,z |
1_555 |
60 |
13 |
8214 |
635.0 |
-17.0 |
0.014 |
0 |
0 |
0 |
1.000 |
Average: |
637.3 |
-16.7 |
0.019 |
1 |
0 |
0 |
1.000 |
5 |
8 |
|
E |
48 |
16 |
14699 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
51 |
19 |
14391 |
479.0 |
-5.5 |
0.196 |
0 |
0 |
0 |
0.000 |
9 |
|
B |
52 |
17 |
14341 |
◊ |
F |
-x,y-1/2,-z+1 |
2_546 |
42 |
16 |
14386 |
428.8 |
-6.4 |
0.150 |
0 |
0 |
0 |
0.000 |
Average: |
453.9 |
-6.0 |
0.173 |
0 |
0 |
0 |
0.000 |
6 |
10 |
|
D |
41 |
12 |
14391 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
42 |
16 |
14341 |
404.1 |
-3.6 |
0.417 |
1 |
1 |
0 |
0.000 |
7 |
11 |
|
[B3P]B:401 |
17 |
1 |
467 |
◊ |
B |
x,y,z |
1_555 |
49 |
17 |
14341 |
318.6 |
4.0 |
0.557 |
2 |
0 |
0 |
0.000 |
8 |
12 |
|
[B3P]D:401 |
17 |
1 |
466 |
◊ |
D |
x,y,z |
1_555 |
48 |
17 |
14391 |
317.4 |
4.5 |
0.576 |
4 |
0 |
0 |
0.000 |
9 |
13 |
|
[DY7]B:402 |
17 |
1 |
474 |
◊ |
B |
x,y,z |
1_555 |
37 |
15 |
14341 |
253.2 |
-1.1 |
0.590 |
1 |
0 |
0 |
0.026 |
14 |
|
[DY7]D:402 |
17 |
1 |
468 |
◊ |
D |
x,y,z |
1_555 |
39 |
16 |
14391 |
250.3 |
-0.5 |
0.693 |
0 |
0 |
0 |
0.026 |
Average: |
251.8 |
-0.8 |
0.641 |
1 |
0 |
0 |
0.026 |
10 |
15 |
|
[PG4]F:402 |
13 |
1 |
414 |
f |
F |
x,y,z |
1_555 |
34 |
13 |
14386 |
204.9 |
3.4 |
0.262 |
2 |
0 |
0 |
0.000 |
11 |
16 |
|
E |
25 |
7 |
14699 |
x |
E |
-x,y-1/2,-z |
2_545 |
20 |
9 |
14699 |
189.4 |
-1.3 |
0.474 |
0 |
0 |
0 |
0.000 |
17 |
|
F |
22 |
7 |
14386 |
x |
F |
-x,y-1/2,-z+1 |
2_546 |
19 |
7 |
14386 |
168.5 |
-1.2 |
0.479 |
0 |
0 |
0 |
0.000 |
Average: |
179.0 |
-1.2 |
0.476 |
0 |
0 |
0 |
0.000 |
12 |
18 |
|
F |
20 |
4 |
14386 |
◊ |
D |
x,y,z |
1_555 |
26 |
5 |
14391 |
184.1 |
-1.9 |
0.415 |
0 |
0 |
0 |
0.221 |
19 |
|
E |
22 |
4 |
14699 |
◊ |
B |
x,y,z |
1_555 |
25 |
5 |
14341 |
168.0 |
-2.6 |
0.326 |
0 |
0 |
0 |
0.221 |
Average: |
176.1 |
-2.3 |
0.371 |
0 |
0 |
0 |
0.221 |
13 |
20 |
|
E |
20 |
6 |
14699 |
◊ |
F |
-x,y-1/2,-z |
2_545 |
18 |
8 |
14386 |
169.8 |
0.5 |
0.711 |
0 |
2 |
0 |
0.000 |
21 |
|
E |
17 |
7 |
14699 |
◊ |
F |
-x,y-1/2,-z+1 |
2_546 |
15 |
6 |
14386 |
140.2 |
1.6 |
0.817 |
0 |
0 |
0 |
0.000 |
Average: |
155.0 |
1.1 |
0.764 |
0 |
1 |
0 |
0.000 |
14 |
22 |
|
[PUT]E:401 |
6 |
1 |
250 |
f |
E |
x,y,z |
1_555 |
37 |
13 |
14699 |
167.1 |
4.7 |
0.496 |
3 |
0 |
0 |
0.000 |
15 |
23 |
|
[PUT]F:401 |
6 |
1 |
248 |
f |
F |
x,y,z |
1_555 |
34 |
13 |
14386 |
162.4 |
5.0 |
0.622 |
3 |
0 |
0 |
0.000 |
16 |
24 |
|
[PGE]E:403 |
9 |
1 |
335 |
f |
E |
x,y,z |
1_555 |
22 |
8 |
14699 |
147.7 |
2.9 |
0.163 |
0 |
0 |
0 |
0.000 |
17 |
25 |
|
[PGE]E:402 |
10 |
1 |
338 |
f |
E |
x,y,z |
1_555 |
23 |
10 |
14699 |
143.7 |
4.2 |
0.257 |
0 |
0 |
0 |
0.000 |
18 |
26 |
|
[DY7]D:402 |
17 |
1 |
468 |
f |
C |
x,y,z |
1_555 |
20 |
5 |
8214 |
131.1 |
-1.8 |
0.553 |
0 |
0 |
0 |
0.231 |
27 |
|
[DY7]B:402 |
17 |
1 |
474 |
f |
A |
x,y,z |
1_555 |
19 |
5 |
7775 |
130.5 |
-2.0 |
0.547 |
0 |
0 |
0 |
0.231 |
Average: |
130.8 |
-1.9 |
0.550 |
0 |
0 |
0 |
0.231 |
19 |
28 |
|
F |
17 |
6 |
14386 |
◊ |
B |
x-1,y,z |
1_455 |
12 |
4 |
14341 |
127.6 |
-0.8 |
0.397 |
0 |
0 |
0 |
0.000 |
20 |
29 |
|
F |
13 |
5 |
14386 |
◊ |
C |
x,y,z |
1_555 |
15 |
5 |
8214 |
107.4 |
-1.7 |
0.401 |
0 |
0 |
0 |
0.019 |
30 |
|
E |
12 |
5 |
14699 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
7775 |
95.5 |
-1.7 |
0.355 |
0 |
0 |
0 |
0.019 |
Average: |
101.5 |
-1.7 |
0.378 |
0 |
0 |
0 |
0.019 |
21 |
31 |
|
[PYR]B:86 |
5 |
1 |
207 |
cf |
B |
x,y,z |
1_555 |
19 |
8 |
14341 |
86.4 |
2.6 |
0.503 |
0 |
0 |
0 |
0.000 |
22 |
32 |
|
[PYR]D:86 |
5 |
1 |
207 |
cf |
D |
x,y,z |
1_555 |
20 |
7 |
14391 |
83.8 |
2.4 |
0.486 |
0 |
0 |
0 |
0.000 |
23 |
33 |
|
[B3P]D:401 |
8 |
1 |
466 |
f |
C |
x,y,z |
1_555 |
7 |
3 |
8214 |
76.6 |
0.7 |
0.330 |
0 |
0 |
0 |
0.000 |
24 |
34 |
|
[B3P]B:401 |
7 |
1 |
467 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
7775 |
74.8 |
-0.6 |
0.253 |
0 |
0 |
0 |
0.049 |
25 |
35 |
|
[PYR]D:86 |
5 |
1 |
207 |
◊ |
C |
x,y,z |
1_555 |
15 |
5 |
8214 |
65.1 |
1.2 |
0.000 |
1 |
0 |
0 |
0.000 |
26 |
36 |
|
[PYR]B:86 |
5 |
1 |
207 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
7775 |
60.2 |
1.1 |
0.818 |
1 |
0 |
0 |
0.000 |
27 |
37 |
|
D |
7 |
2 |
14391 |
◊ |
B |
x,y,z-1 |
1_554 |
5 |
3 |
14341 |
53.0 |
-0.3 |
0.588 |
0 |
0 |
0 |
0.000 |
28 |
38 |
|
[DY7]B:402 |
3 |
1 |
474 |
◊ |
[PYR]B:86 |
x,y,z |
1_555 |
3 |
1 |
207 |
31.6 |
1.1 |
0.887 |
0 |
0 |
0 |
0.000 |
29 |
39 |
|
[DY7]D:402 |
3 |
1 |
468 |
◊ |
[PYR]D:86 |
x,y,z |
1_555 |
3 |
1 |
207 |
27.1 |
0.9 |
0.884 |
0 |
0 |
0 |
0.000 |
30 |
40 |
|
D |
1 |
1 |
14391 |
◊ |
A |
x,y,z-1 |
1_554 |
3 |
2 |
7775 |
25.4 |
0.0 |
0.660 |
0 |
0 |
0 |
0.000 |
41 |
|
C |
3 |
2 |
8214 |
◊ |
B |
x,y,z-1 |
1_554 |
5 |
2 |
14341 |
22.8 |
-0.1 |
0.656 |
0 |
0 |
0 |
0.000 |
Average: |
24.1 |
-0.0 |
0.658 |
0 |
0 |
0 |
0.000 |
31 |
42 |
|
E |
3 |
1 |
14699 |
◊ |
D |
x-1,y,z |
1_455 |
3 |
1 |
14391 |
16.3 |
0.0 |
0.591 |
0 |
0 |
0 |
0.000 |
32 |
43 |
|
B |
2 |
1 |
14341 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
8214 |
13.5 |
0.6 |
0.894 |
0 |
0 |
0 |
0.000 |
33 |
44 |
|
E |
1 |
1 |
14699 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
1 |
1 |
7775 |
2.9 |
-0.1 |
0.435 |
0 |
0 |
0 |
0.000 |
45 |
|
C |
1 |
1 |
8214 |
◊ |
F |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
14386 |
0.3 |
-0.0 |
0.623 |
0 |
0 |
0 |
0.000 |
Average: |
1.6 |
-0.1 |
0.529 |
0 |
0 |
0 |
0.000 |
|