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- PDB-3v4k: First-In-Class Small Molecule Inhibitors of the Single-strand DNA... -

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Basic information

Entry
Database: PDB / ID: 3v4k
TitleFirst-In-Class Small Molecule Inhibitors of the Single-strand DNA Cytosine Deaminase APOBEC3G
ComponentsDNA dC->dU-editing enzyme APOBEC-3G
KeywordsHYDROLASE / APOBEC3G / ANTIVIRAL DEFENSE / HOST-VIRUS INTERACTION / METAL-BINDING / Nucleus
Function / homology
Function and homology information


apolipoprotein B mRNA editing enzyme complex / dCTP deaminase activity / cytidine deamination / base conversion or substitution editing / single-stranded DNA cytosine deaminase / DNA cytosine deamination / : / cytidine to uridine editing / cytidine deaminase activity / negative regulation of viral process ...apolipoprotein B mRNA editing enzyme complex / dCTP deaminase activity / cytidine deamination / base conversion or substitution editing / single-stranded DNA cytosine deaminase / DNA cytosine deamination / : / cytidine to uridine editing / cytidine deaminase activity / negative regulation of viral process / negative regulation of single stranded viral RNA replication via double stranded DNA intermediate / : / retrotransposon silencing / negative regulation of viral genome replication / APOBEC3G mediated resistance to HIV-1 infection / positive regulation of defense response to virus by host / Vif-mediated degradation of APOBEC3G / P-body / defense response to virus / ribonucleoprotein complex / innate immune response / RNA binding / zinc ion binding / identical protein binding / nucleus / cytoplasm / cytosol
Similarity search - Function
APOBEC-like C-terminal domain / Novel AID APOBEC clade 2 / APOBEC/CMP deaminase, zinc-binding / Cytidine and deoxycytidylate deaminases zinc-binding region signature. / Cytidine and deoxycytidylate deaminase domain / Cytidine and deoxycytidylate deaminases domain profile. / Cytidine deaminase-like
Similarity search - Domain/homology
DNA dC->dU-editing enzyme APOBEC-3G
Similarity search - Component
Biological speciesHomo sapiens (human)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / molecular replacement / Resolution: 1.38 Å
AuthorsShandilya, S.M.D. / Ali, A. / Schiffer, C.A.
CitationJournal: Acs Chem.Biol. / Year: 2012
Title: First-In-Class Small Molecule Inhibitors of the Single-Strand DNA Cytosine Deaminase APOBEC3G.
Authors: Li, M. / Shandilya, S.M. / Carpenter, M.A. / Rathore, A. / Brown, W.L. / Perkins, A.L. / Harki, D.A. / Solberg, J. / Hook, D.J. / Pandey, K.K. / Parniak, M.A. / Johnson, J.R. / Krogan, N.J. ...Authors: Li, M. / Shandilya, S.M. / Carpenter, M.A. / Rathore, A. / Brown, W.L. / Perkins, A.L. / Harki, D.A. / Solberg, J. / Hook, D.J. / Pandey, K.K. / Parniak, M.A. / Johnson, J.R. / Krogan, N.J. / Somasundaran, M. / Ali, A. / Schiffer, C.A. / Harris, R.S.
History
DepositionDec 15, 2011Deposition site: RCSB / Processing site: RCSB
Revision 1.0Jan 25, 2012Provider: repository / Type: Initial release
Revision 1.1Mar 28, 2012Group: Database references
Revision 1.2Nov 8, 2017Group: Refinement description / Category: software / Item: _software.name
Revision 1.3Sep 13, 2023Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Refinement description
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model / pdbx_struct_conn_angle / struct_conn / struct_ref_seq_dif / struct_site
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _pdbx_struct_conn_angle.ptnr1_auth_asym_id / _pdbx_struct_conn_angle.ptnr1_auth_comp_id / _pdbx_struct_conn_angle.ptnr1_auth_seq_id / _pdbx_struct_conn_angle.ptnr1_label_asym_id / _pdbx_struct_conn_angle.ptnr1_label_atom_id / _pdbx_struct_conn_angle.ptnr1_label_comp_id / _pdbx_struct_conn_angle.ptnr1_label_seq_id / _pdbx_struct_conn_angle.ptnr2_auth_asym_id / _pdbx_struct_conn_angle.ptnr2_auth_comp_id / _pdbx_struct_conn_angle.ptnr2_auth_seq_id / _pdbx_struct_conn_angle.ptnr2_label_asym_id / _pdbx_struct_conn_angle.ptnr2_label_atom_id / _pdbx_struct_conn_angle.ptnr2_label_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_asym_id / _pdbx_struct_conn_angle.ptnr3_auth_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_seq_id / _pdbx_struct_conn_angle.ptnr3_label_asym_id / _pdbx_struct_conn_angle.ptnr3_label_atom_id / _pdbx_struct_conn_angle.ptnr3_label_comp_id / _pdbx_struct_conn_angle.ptnr3_label_seq_id / _pdbx_struct_conn_angle.value / _struct_conn.pdbx_dist_value / _struct_conn.ptnr1_auth_asym_id / _struct_conn.ptnr1_auth_comp_id / _struct_conn.ptnr1_auth_seq_id / _struct_conn.ptnr1_label_asym_id / _struct_conn.ptnr1_label_atom_id / _struct_conn.ptnr1_label_comp_id / _struct_conn.ptnr1_label_seq_id / _struct_conn.ptnr2_auth_asym_id / _struct_conn.ptnr2_auth_comp_id / _struct_conn.ptnr2_auth_seq_id / _struct_conn.ptnr2_label_asym_id / _struct_conn.ptnr2_label_atom_id / _struct_conn.ptnr2_label_comp_id / _struct_conn.ptnr2_label_seq_id / _struct_ref_seq_dif.details / _struct_site.pdbx_auth_asym_id / _struct_site.pdbx_auth_comp_id / _struct_site.pdbx_auth_seq_id

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: DNA dC->dU-editing enzyme APOBEC-3G
B: DNA dC->dU-editing enzyme APOBEC-3G
hetero molecules


Theoretical massNumber of molelcules
Total (without water)47,65110
Polymers47,2692
Non-polymers3818
Water8,881493
1


  • Idetical with deposited unit
  • defined by author
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
2


  • Idetical with deposited unit
  • defined by author
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
3
A: DNA dC->dU-editing enzyme APOBEC-3G
B: DNA dC->dU-editing enzyme APOBEC-3G
hetero molecules

A: DNA dC->dU-editing enzyme APOBEC-3G
B: DNA dC->dU-editing enzyme APOBEC-3G
hetero molecules


Theoretical massNumber of molelcules
Total (without water)95,30120
Polymers94,5394
Non-polymers76216
Water724
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
crystal symmetry operation1_545x,y-1,z1
Buried area2180 Å2
ΔGint-199 kcal/mol
Surface area18920 Å2
MethodPISA
4
A: DNA dC->dU-editing enzyme APOBEC-3G
B: DNA dC->dU-editing enzyme APOBEC-3G
hetero molecules

A: DNA dC->dU-editing enzyme APOBEC-3G
B: DNA dC->dU-editing enzyme APOBEC-3G
hetero molecules


Theoretical massNumber of molelcules
Total (without water)95,30120
Polymers94,5394
Non-polymers76216
Water724
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
crystal symmetry operation4_445x-1/2,-y-1/2,-z1
Buried area2900 Å2
ΔGint-166 kcal/mol
Surface area18210 Å2
MethodPISA
Unit cell
Length a, b, c (Å)68.190, 72.170, 96.810
Angle α, β, γ (deg.)90.000, 90.000, 90.000
Int Tables number19
Space group name H-MP212121

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Components

#1: Protein DNA dC->dU-editing enzyme APOBEC-3G / APOBEC-related cytidine deaminase / APOBEC-related protein / ARCD / APOBEC-related protein 9 / ARP- ...APOBEC-related cytidine deaminase / APOBEC-related protein / ARCD / APOBEC-related protein 9 / ARP-9 / CEM-15 / CEM15


Mass: 23634.676 Da / Num. of mol.: 2 / Fragment: C-Terminal Domain / Mutation: L234K, C243A, F310K, C356A
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: APOBEC3G, MDS019 / Plasmid: PGEX6P1 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3) CodonPlus (RIL)
References: UniProt: Q9HC16, Hydrolases; Acting on carbon-nitrogen bonds, other than peptide bonds; In cyclic amidines
#2: Chemical ChemComp-CL / CHLORIDE ION


Mass: 35.453 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: Cl
#3: Chemical ChemComp-MG / MAGNESIUM ION


Mass: 24.305 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: Mg
#4: Chemical
ChemComp-ZN / ZINC ION


Mass: 65.409 Da / Num. of mol.: 4 / Source method: obtained synthetically / Formula: Zn
#5: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 493 / Source method: isolated from a natural source / Formula: H2O

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Experimental details

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Experiment

ExperimentMethod: X-RAY DIFFRACTION / Number of used crystals: 1

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Sample preparation

CrystalDensity Matthews: 2.52 Å3/Da / Density % sol: 51.19 %
Crystal growTemperature: 277 K / Method: vapor diffusion, sitting drop / pH: 7.5
Details: 0.1M HEPES, pH 7.5, 10% PEG 4000, 0.1M Magnesium Chloride, vapor diffusion, sitting drop, temperature 277K

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Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: SYNCHROTRON / Site: APS / Beamline: 23-ID-B / Wavelength: 1.033 Å
DetectorType: MARMOSAIC 300 mm CCD / Detector: CCD / Date: Feb 27, 2011 / Details: MIRRORS
RadiationMonochromator: GM/CA monochromator / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 1.033 Å / Relative weight: 1
ReflectionResolution: 1.13→55.75 Å / Num. obs: 121903 / % possible obs: 67.4 % / Biso Wilson estimate: 18.631 Å2 / Rmerge(I) obs: 0.057 / Net I/σ(I): 9.65
Reflection shell

Diffraction-ID: 1

Resolution (Å)Highest resolution (Å)Num. measured obsNum. unique obs% possible allRmerge(I) obsMean I/σ(I) obs
1.13-1.156813973
1.15-1.194428195115.12.3710.51
1.19-1.227955304924.21.7040.72
1.22-1.2611825423234.61.3710.96
1.26-1.316269562247.71.1811.12
1.3-1.3522537760766.20.9481.42
1.35-1.4305871002790.60.7391.87
1.4-1.4530287987892.60.5232.57
1.45-1.5229119951092.90.3573.75
1.52-1.5927977917793.50.2465.13
1.59-1.6826641877894.20.1667.08
1.68-1.7825269834394.30.1268.8
1.78-1.923881791094.80.08512.04
1.9-2.0522215737595.30.0615.77
2.05-2.25205886829950.04819.46
2.25-2.5218750619995.30.04122.2
2.52-2.9116603547194.70.03724.86
2.91-3.56139194586930.03227.9
3.56-5.039899335286.70.02929.12
5.034589161071.60.03328.63

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Phasing

PhasingMethod: molecular replacement
Phasing MRRfactor: 36.75 / Model details: Phaser MODE: MR_AUTO
Highest resolutionLowest resolution
Rotation2.5 Å40.2 Å
Translation2.5 Å40.2 Å

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Processing

Software
NameVersionClassificationNB
MOSFLMdata reduction
XSCALEdata scaling
PHASER2.1.4phasing
REFMACrefmac_5.6.0081refinement
PDB_EXTRACT3.1data extraction
JBluIce-EPICSdata collection
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: PDB ENTRY 3IR2

3ir2


Resolution: 1.38→55.75 Å / Cor.coef. Fo:Fc: 0.965 / Cor.coef. Fo:Fc free: 0.947 / Occupancy max: 1 / Occupancy min: 0.5 / SU B: 1.725 / SU ML: 0.039 / Isotropic thermal model: Isotropic / Cross valid method: THROUGHOUT / σ(F): 0 / ESU R Free: 0.062 / Stereochemistry target values: MAXIMUM LIKELIHOOD
Details: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT U VALUES : WITH TLS ADDED
RfactorNum. reflection% reflectionSelection details
Rfree0.2147 4581 5 %RANDOM
Rwork0.1826 ---
obs0.1842 91307 92.13 %-
Solvent computationIon probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: BABINET MODEL WITH MASK
Displacement parametersBiso max: 66.69 Å2 / Biso mean: 21.7522 Å2 / Biso min: 7.79 Å2
Baniso -1Baniso -2Baniso -3
1--0.51 Å20 Å20 Å2
2--0.38 Å20 Å2
3---0.14 Å2
Refinement stepCycle: LAST / Resolution: 1.38→55.75 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms2966 0 8 493 3467
Refine LS restraints
Refine-IDTypeDev idealDev ideal targetNumber
X-RAY DIFFRACTIONr_bond_refined_d0.010.0213148
X-RAY DIFFRACTIONr_bond_other_d0.0010.022120
X-RAY DIFFRACTIONr_angle_refined_deg1.4091.914300
X-RAY DIFFRACTIONr_angle_other_deg0.88235106
X-RAY DIFFRACTIONr_dihedral_angle_1_deg5.4515398
X-RAY DIFFRACTIONr_dihedral_angle_2_deg34.91722.716162
X-RAY DIFFRACTIONr_dihedral_angle_3_deg13.03915474
X-RAY DIFFRACTIONr_dihedral_angle_4_deg16.5661524
X-RAY DIFFRACTIONr_chiral_restr0.0940.2444
X-RAY DIFFRACTIONr_gen_planes_refined0.0070.0213614
X-RAY DIFFRACTIONr_gen_planes_other0.0010.02742
LS refinement shellResolution: 1.378→1.414 Å / Total num. of bins used: 20
RfactorNum. reflection% reflection
Rfree0.315 336 -
Rwork0.294 6277 -
all-6613 -
obs--91 %
Refinement TLS params.

Method: refined / Refine-ID: X-RAY DIFFRACTION

IDL11 (°2)L12 (°2)L13 (°2)L22 (°2)L23 (°2)L33 (°2)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T11 (Å2)T12 (Å2)T13 (Å2)T22 (Å2)T23 (Å2)T33 (Å2)Origin x (Å)Origin y (Å)Origin z (Å)
120.3877-5.57655.56914.8165-4.05417.81070.03490.8959-0.9307-0.04140.0013-0.35610.58480.4492-0.03610.11070.0456-0.00990.0936-0.11080.1781-12.6321-36.808-9.5063
22.0090.58570.13631.55410.18231.05210.0180.0471-0.0711-0.0457-0.01370.06850.0565-0.059-0.00440.0835-0.00180.00130.0595-0.0080.0568-26.6118-33.7957-5.0239
311.74833.47225.45081.52690.80624.5924-0.00540.1847-0.1218-0.06430.0711-0.00540.10110.2449-0.06570.09150.0317-0.00390.0667-0.01230.0756-13.9192-36.87022.7103
412.79590.9531.27553.74060.7715.7768-0.1291-0.50050.90510.04780.0340.1039-0.59990.3190.09510.1174-0.0121-0.00750.12130.00140.0831.3772-26.741115.1622
58.4685-0.0579-0.40747.16472.71548.85760.0580.43540.2362-0.32950.107-0.1709-0.36190.3501-0.1650.0849-0.0102-0.03070.11690.04930.0663-0.9664-27.47619.9556
623.333310.32077.00458.92515.092411.7470.0316-0.15120.26350.04530.1577-0.33650.0141.037-0.18940.10680.05090.02440.1466-0.01680.114-7.396-37.73442.4022
71.83856.7892-1.405227.8027-4.89451.1111-0.12980.094-0.0619-0.47150.07570.04450.1079-0.09520.05410.11820.0142-0.01530.0422-0.03070.1312-20.4488-50.09511.5783
85.1721-0.98092.55176.5296-2.99329.54320.4792-0.59420.27460.3224-0.13960.44640.2456-0.7398-0.33960.1102-0.07730.00110.1208-0.04080.1365-26.0746-57.87795.5458
95.7348-0.43792.54.50920.33534.1402-0.0655-0.209-0.10170.10690.0264-0.06130.0538-0.03350.03910.09370.015-0.00940.04340.01390.0686-17.0554-44.34189.0295
107.71825.47924.72034.36543.12143.0210.14080.3634-0.4413-0.10330.1609-0.13290.17750.3111-0.30170.12740.0471-0.04980.1082-0.03520.1286-4.0873-41.76113.2251
116.9781-3.84556.61713.1611-5.550410.1075-0.0347-0.2881-0.1450.09230.1120.07560.0487-0.2078-0.07720.1445-0.00580.01490.09370.01320.0554-1.1223-33.774820.2315
122.65960.0811.59780.223-0.31151.5556-0.0168-0.00160.01960.0196-0.0437-0.0286-0.02850.10380.06050.09060.0189-0.01850.0804-0.01740.0664-17.1337-32.64226.8044
139.71431.06915.42260.8883-0.12023.74570.1863-0.2791-0.36820.0875-0.0808-0.07870.0937-0.0469-0.10550.12630.02380.03340.0930.05590.0667-19.0415-39.761618.02
148.2688-4.37799.62914.8444-6.175311.8229-0.0553-0.3494-0.05610.254-0.0147-0.0766-0.1356-0.27090.070.0821-0.0013-0.00340.11780.01010.0682-11.834-31.904815.5685
151.70940.2425-0.22060.203-0.08580.71170.002-0.1811-0.10050.02820.03470.05280.109-0.1903-0.03670.0897-0.00990.00980.10690.03240.0523-29.2844-34.189711.4916
160.7701-0.30151.8322.3902-3.84959.59560.0347-0.16650.04870.1763-0.0992-0.061-0.19080.13050.06450.11240.0017-0.01140.1506-0.03410.0511-19.5622-28.002915.0484
174.2098-0.9532-0.96052.06770.83092.2542-0.01840.0650.0387-0.04010.0037-0.20110.03130.160.01470.0716-0.0035-0.00180.05390.00390.0646-12.7921-26.876-3.9115
1810.2711-3.0801-3.81863.82370.71993.52960.08960.5443-0.0094-0.2666-0.1103-0.09530.04960.04180.02060.0971-0.0116-0.00590.08950.00460.0566-17.7678-24.7105-10.2351
192.01160.7434-1.71390.6707-2.0977.5015-0.0083-0.13370.09380.07420.09670.1128-0.2507-0.1536-0.08840.08570.02710.03890.09180.03720.1447-28.1484-21.43171.8912
208.6701-0.52172.83711.0598-1.947210.30780.0313-0.20780.38590.43030.08370.2002-0.5222-0.1685-0.11510.07520.0280.04340.0882-0.00810.0584-29.4609-24.214212.9256
2113.8967-4.2448-0.20566.88231.89419.5987-0.04870.22650.47720.0425-0.00150.4032-0.523-0.43620.05020.11090.0096-0.03150.04830.03650.0952-20.85411.5319-7.3877
222.2970.60761.44393.3783-2.64693.80030.08820.1448-0.0928-0.0894-0.0935-0.11420.13430.1830.00530.08890.0039-0.00440.0756-0.01040.0522-10.8705-4.3187-3.5258
234.9117-0.169-1.95063.65281.27063.58090.0714-0.04250.1516-0.1662-0.0343-0.0799-0.18620.1615-0.03710.0757-0.0190.00770.0940.00520.0369-3.96320.6634-2.7288
2411.45174.5213-8.9112.8349-2.88637.441-0.07730.0947-0.10810.0202-0.06440.02110.0784-0.28030.14170.07550.015-0.01650.1704-0.01170.0592-25.0087-0.32488.6088
2514.2551-3.3862.47447.2472-0.530511.61390.17030.009-0.8279-0.1432-0.12890.18960.50250.0292-0.04150.0834-0.03950.02920.1201-0.00130.0757-33.7925-8.647816.0618
269.14326.7387-3.3076.4826-4.69025.4162-0.0712-0.08240.54820.11360.45340.6551-0.0431-0.7935-0.38230.06290.03490.06770.22640.01980.1485-29.16332.62145.4187
271.66743.7163-0.800220.24630.99911.0312-0.06460.02480.0477-0.74230.1681-0.2509-0.10860.0137-0.10340.12560.0072-0.03370.01780.00920.1026-12.405917.87141.974
285.161911.0005-3.769324.7232-8.05512.75650.2588-0.845-0.082-0.8288-0.6973-0.3150.06690.60170.43850.3429-0.35890.0030.5862-0.08580.2411-9.00819.60336.9661
297.37680.7106-3.05931.166-0.93962.9333-0.0707-0.08220.20120.1210.08070.146-0.0718-0.2862-0.010.09630.0262-0.00670.0715-0.02950.0659-22.36429.294811.5009
308.2824-4.8886-1.31833.76673.958811.6932-0.2391-0.0837-0.17810.165-0.05480.16510.0185-0.5630.29390.098-0.0120.06670.1908-0.05270.0568-33.48312.32722.1264
311.36720.0044-0.41270.14310.19870.588-0.0012-0.0725-0.01230.0522-0.04120.0333-0.0056-0.13840.04240.07480.01240.00660.0843-0.00630.0492-16.786-0.305510.428
329.01010.6628-5.25221.6422-0.5876.08910.1717-0.29440.39730.0808-0.1140.0382-0.22540.0389-0.05770.09110.0135-0.0130.0858-0.04180.0509-16.23316.507119.8526
338.0954-5.4161-9.23826.64277.08410.87850.0264-0.25990.11340.32070.02180.01140.0970.1421-0.04810.068-0.02370.01770.195-0.06140.0411-22.1275-1.355317.5553
341.41660.14660.38120.30190.45991.81160.0051-0.08770.12970.01360.0243-0.0584-0.12030.1253-0.02930.0790.0037-0.00630.0562-0.01220.063-5.0521-0.214213.327
354.76110.27520.75718.51377.24718.59460.1041-0.27260.03980.2526-0.11960.06650.0946-0.0940.01560.081-0.00060.00780.09750.01150.0432-15.034-4.005920.4432
361.5497-0.16191.08180.4795-0.00581.2439-0.0045-0.1114-0.01940.00240.02020.1062-0.0135-0.1987-0.01570.0737-0.0062-0.00250.0625-0.00220.0511-20.472-9.14230.9008
376.70951.68161.38015.76463.18315.4476-0.00510.31320.3173-0.2834-0.11970.2938-0.1363-0.19960.12480.07380.0048-0.03970.08480.02160.0685-26.1205-5.167-9.9633
3810.2275-3.25466.05434.2311-2.15865.21050.0940.4332-0.1645-0.13270.06030.04010.00210.2081-0.15440.084-0.01370.00910.0725-0.02070.0552-13.2381-13.2509-4.4701
394.26980.38420.54933.29-0.570813.2332-0.02880.131-0.384-0.0417-0.0058-0.00920.3718-0.08250.03460.077-0.0033-0.01180.0379-0.01520.0856-6.9548-13.37645.9561
405.74630.9184-2.06365.92840.8727.2492-0.0626-0.1971-0.29310.3591-0.00480.02770.4561-0.10620.06740.08730.0078-0.02010.0592-0.00050.0641-5.121-10.452115.4037
Refinement TLS group
IDRefine-IDRefine TLS-IDAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1A195 - 200
2X-RAY DIFFRACTION2A201 - 216
3X-RAY DIFFRACTION3A217 - 224
4X-RAY DIFFRACTION4A225 - 229
5X-RAY DIFFRACTION5A230 - 237
6X-RAY DIFFRACTION6A238 - 242
7X-RAY DIFFRACTION7A243 - 248
8X-RAY DIFFRACTION8A249 - 254
9X-RAY DIFFRACTION9A255 - 264
10X-RAY DIFFRACTION10A265 - 272
11X-RAY DIFFRACTION11A273 - 277
12X-RAY DIFFRACTION12A278 - 287
13X-RAY DIFFRACTION13A288 - 302
14X-RAY DIFFRACTION14A303 - 310
15X-RAY DIFFRACTION15A311 - 328
16X-RAY DIFFRACTION16A329 - 337
17X-RAY DIFFRACTION17A338 - 353
18X-RAY DIFFRACTION18A354 - 364
19X-RAY DIFFRACTION19A365 - 373
20X-RAY DIFFRACTION20A374 - 380
21X-RAY DIFFRACTION21B195 - 201
22X-RAY DIFFRACTION22B202 - 210
23X-RAY DIFFRACTION23B211 - 217
24X-RAY DIFFRACTION24B218 - 227
25X-RAY DIFFRACTION25B228 - 234
26X-RAY DIFFRACTION26B235 - 242
27X-RAY DIFFRACTION27B243 - 250
28X-RAY DIFFRACTION28B251 - 256
29X-RAY DIFFRACTION29B257 - 270
30X-RAY DIFFRACTION30B271 - 276
31X-RAY DIFFRACTION31B277 - 289
32X-RAY DIFFRACTION32B290 - 302
33X-RAY DIFFRACTION33B303 - 310
34X-RAY DIFFRACTION34B311 - 329
35X-RAY DIFFRACTION35B330 - 335
36X-RAY DIFFRACTION36B336 - 350
37X-RAY DIFFRACTION37B351 - 357
38X-RAY DIFFRACTION38B358 - 366
39X-RAY DIFFRACTION39B367 - 373
40X-RAY DIFFRACTION40B374 - 380

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