Deposited unit | A: Putative short-chain dehydrogenase/reductase B: Putative short-chain dehydrogenase/reductase C: Putative short-chain dehydrogenase/reductase D: Putative short-chain dehydrogenase/reductase hetero molecules
| Theoretical mass | Number of molelcules |
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Total (without water) | 117,105 | 9 |
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Polymers | 116,644 | 4 |
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Non-polymers | 460 | 5 |
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Water | 9,458 | 525 |
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1 | A: Putative short-chain dehydrogenase/reductase C: Putative short-chain dehydrogenase/reductase hetero molecules
| Theoretical mass | Number of molelcules |
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Total (without water) | 58,599 | 5 |
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Polymers | 58,322 | 2 |
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Non-polymers | 276 | 3 |
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Water | 36 | 2 |
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Type | Name | Symmetry operation | Number |
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identity operation | 1_555 | x,y,z | 1 |
Buried area | 3530 Å2 |
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ΔGint | -26 kcal/mol |
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Surface area | 22160 Å2 |
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Method | PISA |
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2 | B: Putative short-chain dehydrogenase/reductase D: Putative short-chain dehydrogenase/reductase hetero molecules
| Theoretical mass | Number of molelcules |
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Total (without water) | 58,506 | 4 |
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Polymers | 58,322 | 2 |
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Non-polymers | 184 | 2 |
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Water | 36 | 2 |
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Type | Name | Symmetry operation | Number |
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identity operation | 1_555 | x,y,z | 1 |
Buried area | 3380 Å2 |
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ΔGint | -26 kcal/mol |
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Surface area | 22140 Å2 |
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Method | PISA |
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3 |
- Idetical with deposited unit
- defined by software
Type | Name | Symmetry operation | Number |
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identity operation | 1_555 | x,y,z | 1 |
Buried area | 19340 Å2 |
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ΔGint | -122 kcal/mol |
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Surface area | 31870 Å2 |
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Method | PISA |
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Unit cell | Length a, b, c (Å) | 86.290, 54.760, 115.730 |
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Angle α, β, γ (deg.) | 90.000, 100.250, 90.000 |
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Int Tables number | 4 |
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Space group name H-M | P1211 |
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Noncrystallographic symmetry (NCS) | NCS domain: ID | Ens-ID | Details |
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1 | 1 | (chain A and (resid 11:48 or (resid 49 and (name...2 | 1 | (chain B and ((resid 11 and (name N or name...3 | 1 | (chain C and ((resid 11 and (name N or name...4 | 1 | (chain D and (resid 11:49 or resid 51:56 or resid... | | | |
NCS domain segments: Dom-ID | Component-ID | Ens-ID | Selection details | Auth asym-ID | Auth seq-ID |
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1 | 1 | 1 | (chain A and (resid 11:48 or (resid 49 and (name...A11 - 48 | 1 | 2 | 1 | (chain A and (resid 11:48 or (resid 49 and (name...A49 | 1 | 3 | 1 | (chain A and (resid 11:48 or (resid 49 and (name...A11 - 300 | 1 | 4 | 1 | (chain A and (resid 11:48 or (resid 49 and (name...A11 - 300 | 1 | 5 | 1 | (chain A and (resid 11:48 or (resid 49 and (name...A11 - 300 | 1 | 6 | 1 | (chain A and (resid 11:48 or (resid 49 and (name...A11 - 300 | 2 | 1 | 1 | (chain B and ((resid 11 and (name N or name...B11 | 2 | 2 | 1 | (chain B and ((resid 11 and (name N or name...B10 - 300 | 2 | 3 | 1 | (chain B and ((resid 11 and (name N or name...B10 - 300 | 2 | 4 | 1 | (chain B and ((resid | | | | | | | | | | | | | | | | | | |
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