## |
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 |
|
F |
109 |
28 |
18375 |
◊ |
E |
x,y,z |
1_555 |
115 |
28 |
18511 |
1040.4 |
-6.0 |
0.284 |
12 |
8 |
0 |
0.251 |
2 |
|
H |
119 |
29 |
18482 |
◊ |
G |
x,y,z |
1_555 |
116 |
28 |
17218 |
1036.7 |
-6.0 |
0.357 |
12 |
11 |
0 |
0.251 |
3 |
|
D |
119 |
28 |
18398 |
◊ |
C |
x,y,z |
1_555 |
113 |
29 |
18046 |
1035.9 |
-9.0 |
0.175 |
13 |
7 |
0 |
0.251 |
4 |
|
B |
115 |
28 |
18418 |
◊ |
A |
x,y,z |
1_555 |
113 |
28 |
18048 |
1029.8 |
-4.5 |
0.468 |
13 |
9 |
0 |
0.251 |
Average: |
1035.7 |
-6.4 |
0.321 |
13 |
9 |
0 |
0.251 |
2 |
5 |
|
H |
87 |
25 |
18482 |
◊ |
E |
x,y,z |
1_555 |
94 |
27 |
18511 |
862.2 |
-1.5 |
0.509 |
8 |
14 |
0 |
0.169 |
6 |
|
C |
87 |
24 |
18046 |
◊ |
B |
x,y,z |
1_555 |
86 |
23 |
18418 |
835.0 |
-2.9 |
0.458 |
13 |
10 |
0 |
0.169 |
7 |
|
G |
90 |
27 |
17218 |
◊ |
F |
x,y,z |
1_555 |
83 |
24 |
18375 |
833.5 |
-1.5 |
0.608 |
14 |
10 |
0 |
0.169 |
8 |
|
D |
83 |
25 |
18398 |
◊ |
A |
x,y,z |
1_555 |
89 |
26 |
18048 |
821.0 |
-2.4 |
0.550 |
15 |
10 |
0 |
0.169 |
Average: |
837.9 |
-2.1 |
0.531 |
13 |
11 |
0 |
0.169 |
3 |
9 |
|
D |
66 |
15 |
18398 |
◊ |
E |
-y+2,x-y,z+2/3 |
2_755 |
68 |
17 |
18511 |
614.8 |
6.3 |
0.928 |
10 |
6 |
0 |
0.000 |
4 |
10 |
|
[ADP]E:501 |
26 |
1 |
563 |
f |
E |
x,y,z |
1_555 |
50 |
23 |
18511 |
394.3 |
-5.9 |
0.591 |
13 |
0 |
0 |
0.390 |
11 |
|
[ADP]F:501 |
26 |
1 |
567 |
f |
F |
x,y,z |
1_555 |
53 |
23 |
18375 |
394.1 |
-6.9 |
0.530 |
13 |
0 |
0 |
0.390 |
12 |
|
[ADP]A:501 |
26 |
1 |
559 |
f |
A |
x,y,z |
1_555 |
52 |
23 |
18048 |
393.4 |
-5.8 |
0.633 |
12 |
0 |
0 |
0.390 |
13 |
|
[ADP]B:501 |
26 |
1 |
563 |
f |
B |
x,y,z |
1_555 |
51 |
24 |
18418 |
390.8 |
-6.9 |
0.533 |
13 |
0 |
0 |
0.390 |
14 |
|
[ADP]D:501 |
26 |
1 |
566 |
f |
D |
x,y,z |
1_555 |
50 |
22 |
18398 |
389.0 |
-7.4 |
0.463 |
11 |
0 |
0 |
0.390 |
15 |
|
[ADP]H:501 |
26 |
1 |
562 |
f |
H |
x,y,z |
1_555 |
56 |
23 |
18482 |
387.6 |
-7.1 |
0.494 |
13 |
0 |
0 |
0.390 |
16 |
|
[ADP]C:501 |
26 |
1 |
561 |
f |
C |
x,y,z |
1_555 |
50 |
21 |
18046 |
384.6 |
-6.7 |
0.493 |
11 |
0 |
0 |
0.390 |
17 |
|
[ADP]G:501 |
26 |
1 |
565 |
f |
G |
x,y,z |
1_555 |
47 |
19 |
17218 |
358.9 |
-4.7 |
0.685 |
10 |
0 |
0 |
0.390 |
Average: |
386.6 |
-6.4 |
0.553 |
12 |
0 |
0 |
0.390 |
5 |
18 |
|
H |
27 |
10 |
18482 |
◊ |
D |
x-y+1,x,z-2/3 |
6_654 |
23 |
6 |
18398 |
269.8 |
1.9 |
0.802 |
7 |
8 |
0 |
0.000 |
19 |
|
E |
22 |
7 |
18511 |
◊ |
A |
x-y+1,x,z-2/3 |
6_654 |
27 |
11 |
18048 |
231.0 |
1.2 |
0.765 |
5 |
8 |
0 |
0.000 |
Average: |
250.4 |
1.6 |
0.783 |
6 |
8 |
0 |
0.000 |
6 |
20 |
|
[F6P]C:502 |
16 |
1 |
374 |
cf |
C |
x,y,z |
1_555 |
39 |
17 |
18046 |
265.6 |
-2.6 |
0.510 |
7 |
0 |
0 |
0.090 |
21 |
|
[F6P]E:502 |
16 |
1 |
371 |
f |
E |
x,y,z |
1_555 |
39 |
17 |
18511 |
264.0 |
-1.6 |
0.578 |
8 |
0 |
0 |
0.090 |
Average: |
264.8 |
-2.1 |
0.544 |
8 |
0 |
0 |
0.090 |
7 |
22 |
|
[F6P]B:502 |
16 |
1 |
364 |
f |
B |
x,y,z |
1_555 |
37 |
17 |
18418 |
262.1 |
-1.5 |
0.565 |
10 |
0 |
0 |
0.114 |
23 |
|
[F6P]D:502 |
16 |
1 |
368 |
f |
D |
x,y,z |
1_555 |
38 |
18 |
18398 |
261.1 |
-1.8 |
0.573 |
12 |
0 |
0 |
0.114 |
24 |
|
[F6P]F:502 |
16 |
1 |
371 |
f |
F |
x,y,z |
1_555 |
33 |
17 |
18375 |
260.8 |
-2.3 |
0.560 |
9 |
0 |
0 |
0.114 |
Average: |
261.3 |
-1.9 |
0.566 |
10 |
0 |
0 |
0.114 |
8 |
25 |
|
F |
34 |
11 |
18375 |
x |
F |
x-y+1,x,z+1/3 |
6_655 |
28 |
8 |
18375 |
257.1 |
3.6 |
0.842 |
2 |
4 |
0 |
0.000 |
26 |
|
D |
29 |
12 |
18398 |
x |
C |
-y+2,x-y,z-1/3 |
2_754 |
25 |
8 |
18046 |
222.7 |
2.9 |
0.820 |
3 |
3 |
0 |
0.000 |
Average: |
239.9 |
3.3 |
0.831 |
3 |
4 |
0 |
0.000 |
9 |
27 |
|
E |
26 |
9 |
18511 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
18418 |
240.8 |
2.5 |
0.750 |
5 |
4 |
0 |
0.000 |
28 |
|
H |
27 |
6 |
18482 |
◊ |
C |
x,y,z |
1_555 |
26 |
9 |
18046 |
222.0 |
1.0 |
0.696 |
4 |
3 |
0 |
0.000 |
Average: |
231.4 |
1.8 |
0.723 |
5 |
4 |
0 |
0.000 |
10 |
29 |
|
G |
24 |
13 |
17218 |
◊ |
F |
x-y+1,x,z+1/3 |
6_655 |
25 |
10 |
18375 |
211.5 |
0.9 |
0.638 |
1 |
1 |
0 |
0.000 |
30 |
|
A |
27 |
12 |
18048 |
◊ |
C |
-y+2,x-y,z-1/3 |
2_754 |
23 |
9 |
18046 |
194.4 |
0.5 |
0.690 |
2 |
1 |
0 |
0.000 |
Average: |
202.9 |
0.7 |
0.664 |
2 |
1 |
0 |
0.000 |
11 |
31 |
|
H |
19 |
8 |
18482 |
◊ |
B |
x,y,z |
1_555 |
20 |
9 |
18418 |
159.6 |
-0.2 |
0.583 |
1 |
0 |
0 |
0.000 |
12 |
32 |
|
G |
14 |
5 |
17218 |
x |
G |
x-y+1,x,z+1/3 |
6_655 |
17 |
7 |
17218 |
133.3 |
1.3 |
0.781 |
2 |
1 |
0 |
0.000 |
33 |
|
A |
14 |
5 |
18048 |
x |
B |
-y+2,x-y,z-1/3 |
2_754 |
14 |
6 |
18418 |
115.8 |
0.9 |
0.744 |
1 |
0 |
0 |
0.000 |
Average: |
124.6 |
1.1 |
0.762 |
2 |
1 |
0 |
0.000 |
13 |
34 |
|
H |
13 |
4 |
18482 |
◊ |
B |
-x+3,-y+2,z |
4_875 |
13 |
4 |
18418 |
126.9 |
2.6 |
0.898 |
4 |
5 |
0 |
0.000 |
14 |
35 |
|
[EDO]A:502 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
21 |
6 |
18048 |
106.3 |
2.7 |
0.429 |
1 |
0 |
0 |
0.000 |
15 |
36 |
|
[EDO]C:503 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
15 |
6 |
18046 |
106.1 |
2.7 |
0.380 |
1 |
0 |
0 |
0.000 |
16 |
37 |
|
[PO4]D:504 |
5 |
1 |
188 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
18398 |
78.6 |
-4.0 |
0.895 |
3 |
0 |
0 |
0.085 |
17 |
38 |
|
[PO4]F:503 |
5 |
1 |
189 |
f |
F |
x,y,z |
1_555 |
9 |
4 |
18375 |
74.6 |
-4.1 |
0.807 |
2 |
0 |
0 |
0.020 |
18 |
39 |
|
F |
12 |
4 |
18375 |
◊ |
G |
-y+2,x-y+1,z-1/3 |
2_764 |
8 |
4 |
17218 |
74.0 |
-0.3 |
0.534 |
0 |
2 |
0 |
0.000 |
40 |
|
C |
8 |
3 |
18046 |
◊ |
A |
x-y+1,x,z+1/3 |
6_655 |
10 |
4 |
18048 |
70.1 |
0.7 |
0.697 |
1 |
2 |
0 |
0.000 |
Average: |
72.0 |
0.2 |
0.615 |
1 |
2 |
0 |
0.000 |
19 |
41 |
|
[PO4]H:503 |
4 |
1 |
188 |
f |
H |
x,y,z |
1_555 |
9 |
4 |
18482 |
71.0 |
-3.9 |
0.786 |
3 |
0 |
0 |
0.025 |
20 |
42 |
|
[EDO]H:502 |
3 |
1 |
183 |
f |
H |
x,y,z |
1_555 |
9 |
4 |
18482 |
61.5 |
1.2 |
0.742 |
4 |
0 |
0 |
0.003 |
21 |
43 |
|
[EDO]H:502 |
2 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
18418 |
49.9 |
1.0 |
0.434 |
1 |
0 |
0 |
0.000 |
22 |
44 |
|
[PO4]H:504 |
4 |
1 |
188 |
f |
H |
x,y,z |
1_555 |
5 |
3 |
18482 |
46.6 |
-1.2 |
0.959 |
2 |
0 |
0 |
0.010 |
23 |
45 |
|
[PO4]D:503 |
4 |
1 |
188 |
f |
D |
x,y,z |
1_555 |
3 |
2 |
18398 |
44.6 |
-1.3 |
0.960 |
2 |
0 |
0 |
0.034 |
24 |
46 |
|
[PO4]B:503 |
4 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
18418 |
44.4 |
-0.9 |
0.959 |
1 |
0 |
0 |
0.011 |
25 |
47 |
|
[F6P]C:502 |
6 |
1 |
374 |
f |
[ADP]C:501 |
x,y,z |
1_555 |
4 |
1 |
561 |
42.2 |
-1.5 |
0.441 |
0 |
0 |
0 |
0.025 |
48 |
|
[F6P]E:502 |
6 |
1 |
371 |
f |
[ADP]E:501 |
x,y,z |
1_555 |
4 |
1 |
563 |
41.7 |
-1.6 |
0.450 |
0 |
0 |
0 |
0.025 |
49 |
|
[F6P]B:502 |
6 |
1 |
364 |
f |
[ADP]B:501 |
x,y,z |
1_555 |
4 |
1 |
563 |
36.6 |
-1.5 |
0.476 |
0 |
0 |
0 |
0.025 |
50 |
|
[F6P]F:502 |
4 |
1 |
371 |
f |
[ADP]F:501 |
x,y,z |
1_555 |
4 |
1 |
567 |
35.3 |
-1.1 |
0.500 |
0 |
0 |
0 |
0.025 |
Average: |
39.0 |
-1.4 |
0.467 |
0 |
0 |
0 |
0.025 |
26 |
51 |
|
[EDO]C:503 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
18418 |
39.8 |
1.0 |
0.794 |
0 |
0 |
0 |
0.000 |
27 |
52 |
|
[F6P]D:502 |
5 |
1 |
368 |
f |
[ADP]D:501 |
x,y,z |
1_555 |
4 |
1 |
566 |
37.4 |
-1.4 |
0.478 |
0 |
0 |
0 |
0.022 |
28 |
53 |
|
E |
6 |
5 |
18511 |
◊ |
D |
x-y+1,x,z-2/3 |
6_654 |
6 |
5 |
18398 |
19.8 |
-0.1 |
0.574 |
0 |
0 |
0 |
0.000 |
|