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- PDB-3m45: Crystal structure of Ig1 domain of mouse SynCAM 2 -

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Basic information

Entry
Database: PDB / ID: 3m45
TitleCrystal structure of Ig1 domain of mouse SynCAM 2
ComponentsCell adhesion molecule 2
KeywordsCELL ADHESION / Ig fold / dimer / disulfide bond / glycoprotein / immunoglobulin domain / membrane / transmembrane
Function / homology
Function and homology information


Adherens junctions interactions / neuronal cell body membrane / membrane => GO:0016020 / cell adhesion / axon / synapse / cytoplasm
Similarity search - Function
Neurexin/syndecan/glycophorin C / putative band 4.1 homologues' binding motif / CD80-like, immunoglobulin C2-set / CD80-like C2-set immunoglobulin domain / Immunoglobulin subtype 2 / Immunoglobulin C-2 Type / Immunoglobulin V-set domain / Immunoglobulin V-set domain / Immunoglobulin subtype / Immunoglobulin ...Neurexin/syndecan/glycophorin C / putative band 4.1 homologues' binding motif / CD80-like, immunoglobulin C2-set / CD80-like C2-set immunoglobulin domain / Immunoglobulin subtype 2 / Immunoglobulin C-2 Type / Immunoglobulin V-set domain / Immunoglobulin V-set domain / Immunoglobulin subtype / Immunoglobulin / Ig-like domain profile. / Immunoglobulin-like domain / Immunoglobulin-like domain superfamily / Immunoglobulins / Immunoglobulin-like fold / Immunoglobulin-like / Sandwich / Mainly Beta
Similarity search - Domain/homology
Cell adhesion molecule 2
Similarity search - Component
Biological speciesMus musculus (house mouse)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.21 Å
AuthorsYue, L. / Modis, Y.
CitationJournal: J.Biol.Chem. / Year: 2010
Title: N-glycosylation at the SynCAM (synaptic cell adhesion molecule) immunoglobulin interface modulates synaptic adhesion.
Authors: Fogel, A.I. / Li, Y. / Giza, J. / Wang, Q. / Lam, T.T. / Modis, Y. / Biederer, T.
History
DepositionMar 10, 2010Deposition site: RCSB / Processing site: RCSB
Revision 1.0Sep 8, 2010Provider: repository / Type: Initial release
Revision 1.1Jul 13, 2011Group: Version format compliance
Revision 1.2Jul 29, 2020Group: Data collection / Derived calculations / Structure summary
Category: chem_comp / entity ...chem_comp / entity / pdbx_chem_comp_identifier / pdbx_entity_nonpoly / struct_conn / struct_site / struct_site_gen
Item: _chem_comp.name / _chem_comp.type ..._chem_comp.name / _chem_comp.type / _entity.pdbx_description / _pdbx_entity_nonpoly.name / _struct_conn.pdbx_dist_value / _struct_conn.pdbx_leaving_atom_flag / _struct_conn.pdbx_role / _struct_conn.ptnr1_auth_asym_id / _struct_conn.ptnr1_auth_seq_id / _struct_conn.ptnr1_label_asym_id / _struct_conn.ptnr1_label_seq_id / _struct_conn.ptnr2_auth_asym_id / _struct_conn.ptnr2_auth_seq_id / _struct_conn.ptnr2_label_asym_id
Description: Carbohydrate remediation / Provider: repository / Type: Remediation
Revision 1.3Sep 6, 2023Group: Data collection / Database references ...Data collection / Database references / Refinement description / Structure summary
Category: chem_comp / chem_comp_atom ...chem_comp / chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model
Item: _chem_comp.pdbx_synonyms / _database_2.pdbx_DOI / _database_2.pdbx_database_accession

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: Cell adhesion molecule 2
B: Cell adhesion molecule 2
C: Cell adhesion molecule 2
D: Cell adhesion molecule 2
hetero molecules


Theoretical massNumber of molelcules
Total (without water)49,29011
Polymers47,7414
Non-polymers1,5487
Water3,459192
1
A: Cell adhesion molecule 2
D: Cell adhesion molecule 2
hetero molecules


Theoretical massNumber of molelcules
Total (without water)24,5345
Polymers23,8712
Non-polymers6643
Water362
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area1930 Å2
ΔGint-2 kcal/mol
Surface area10350 Å2
MethodPISA
2
B: Cell adhesion molecule 2
C: Cell adhesion molecule 2
hetero molecules


Theoretical massNumber of molelcules
Total (without water)24,7566
Polymers23,8712
Non-polymers8854
Water362
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area2110 Å2
ΔGint1 kcal/mol
Surface area10630 Å2
MethodPISA
Unit cell
Length a, b, c (Å)42.847, 50.528, 79.851
Angle α, β, γ (deg.)75.91, 77.02, 65.18
Int Tables number1
Space group name H-MP1

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Components

#1: Protein
Cell adhesion molecule 2 / / Immunoglobulin superfamily member 4D / IgSF4D / Nectin-like protein 3 / NECL-3


Mass: 11935.353 Da / Num. of mol.: 4 / Fragment: Ig1 domain
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Mus musculus (house mouse) / Gene: Cadm2, Igsf4d, Necl3, SynCAM 2 / Plasmid: pCMVIG9 / Cell (production host): Embryonic Kidney Cell / Cell line (production host): HEK293 / Production host: Homo sapiens (human) / References: UniProt: Q8BLQ9
#2: Sugar
ChemComp-NAG / 2-acetamido-2-deoxy-beta-D-glucopyranose / N-acetyl-beta-D-glucosamine / 2-acetamido-2-deoxy-beta-D-glucose / 2-acetamido-2-deoxy-D-glucose / 2-acetamido-2-deoxy-glucose / N-ACETYL-D-GLUCOSAMINE / N-Acetylglucosamine


Type: D-saccharide, beta linking / Mass: 221.208 Da / Num. of mol.: 7
Source method: isolated from a genetically manipulated source
Formula: C8H15NO6
IdentifierTypeProgram
DGlcpNAcbCONDENSED IUPAC CARBOHYDRATE SYMBOLGMML 1.0
N-acetyl-b-D-glucopyranosamineCOMMON NAMEGMML 1.0
b-D-GlcpNAcIUPAC CARBOHYDRATE SYMBOLPDB-CARE 1.0
GlcNAcSNFG CARBOHYDRATE SYMBOLGMML 1.0
#3: Water ChemComp-HOH / water / Water


Mass: 18.015 Da / Num. of mol.: 192 / Source method: isolated from a natural source / Formula: H2O
Sequence detailsTHE DEPOSITED SEQUENCE CORRESPONDS TO THE SEQUENCE OF ISOFORM 2 OF THE UNIPROT ENTRY Q8BLQ9

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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: 3.16 Å3/Da / Density % sol: 61.04 %
Crystal growTemperature: 293 K
Details: 0.1 M HEPES, pH 6.5-7.0, 21% PEG5000 monomethyl ether, VAPOR DIFFUSION, SITTING DROP, temperature 293K
PH range: 6.5-7.0

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Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: SYNCHROTRON / Site: NSLS / Beamline: X29A / Wavelength: 1.03848
DetectorType: ADSC QUANTUM 315 / Detector: CCD / Date: Nov 8, 2008
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 1.03848 Å / Relative weight: 1
ReflectionResolution: 2.21→50 Å / Num. obs: 27498 / % possible obs: 93.9 % / Observed criterion σ(I): 2.2 / Redundancy: 3.6 % / Biso Wilson estimate: 30.8 Å2 / Rmerge(I) obs: 0.092 / Net I/σ(I): 15.27
Reflection shellResolution: 2.21→2.26 Å / Redundancy: 3.2 % / Rmerge(I) obs: 0.4 / Mean I/σ(I) obs: 3.39 / % possible all: 64.1

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Processing

Software
NameVersionClassification
HKL-2000data collection
PHASESphasing
REFMAC5.6.0031refinement
HKL-2000data reduction
HKL-2000data scaling
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: A MONOMER OF HUMAN SYNCAM 3 (NECTIN-LIKE MOLECULE 1) IG1, PROTEIN DATA BANK CODE 1Z9M

1z9m


Resolution: 2.21→50 Å / Cor.coef. Fo:Fc: 0.954 / Cor.coef. Fo:Fc free: 0.926 / SU B: 13.049 / SU ML: 0.147 / Cross valid method: THROUGHOUT / σ(F): 2 / ESU R: 0.237 / ESU R Free: 0.203 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT
RfactorNum. reflection% reflectionSelection details
Rfree0.245 1383 5 %RANDOM
Rwork0.198 ---
obs0.2 26095 94 %-
all-29225 --
Solvent computationIon probe radii: 1 Å / Shrinkage radii: 1 Å / VDW probe radii: 1.4 Å / Solvent model: MASK
Displacement parametersBiso mean: 45.012 Å2
Baniso -1Baniso -2Baniso -3
1--1.96 Å2-0.42 Å21.46 Å2
2--2.52 Å2-3.35 Å2
3---0.77 Å2
Refinement stepCycle: LAST / Resolution: 2.21→50 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms3099 0 98 192 3389
Refine LS restraints
Refine-IDTypeDev idealDev ideal targetNumber
X-RAY DIFFRACTIONr_bond_refined_d0.0230.0223266
X-RAY DIFFRACTIONr_bond_other_d
X-RAY DIFFRACTIONr_angle_refined_deg2.2341.9874460
X-RAY DIFFRACTIONr_angle_other_deg
X-RAY DIFFRACTIONr_dihedral_angle_1_deg7.35392
X-RAY DIFFRACTIONr_dihedral_angle_2_deg36.18325.245143
X-RAY DIFFRACTIONr_dihedral_angle_3_deg18.30215532
X-RAY DIFFRACTIONr_dihedral_angle_4_deg23.6041516
X-RAY DIFFRACTIONr_chiral_restr0.1610.2541
X-RAY DIFFRACTIONr_gen_planes_refined0.010.0212438
X-RAY DIFFRACTIONr_gen_planes_other
X-RAY DIFFRACTIONr_nbd_refined
X-RAY DIFFRACTIONr_nbd_other
X-RAY DIFFRACTIONr_nbtor_refined
X-RAY DIFFRACTIONr_nbtor_other
X-RAY DIFFRACTIONr_xyhbond_nbd_refined
X-RAY DIFFRACTIONr_xyhbond_nbd_other
X-RAY DIFFRACTIONr_metal_ion_refined
X-RAY DIFFRACTIONr_metal_ion_other
X-RAY DIFFRACTIONr_symmetry_vdw_refined
X-RAY DIFFRACTIONr_symmetry_vdw_other
X-RAY DIFFRACTIONr_symmetry_hbond_refined
X-RAY DIFFRACTIONr_symmetry_hbond_other
X-RAY DIFFRACTIONr_symmetry_metal_ion_refined
X-RAY DIFFRACTIONr_symmetry_metal_ion_other
X-RAY DIFFRACTIONr_mcbond_it0.9711.51977
X-RAY DIFFRACTIONr_mcbond_other
X-RAY DIFFRACTIONr_mcangle_it1.79423225
X-RAY DIFFRACTIONr_scbond_it3.61931289
X-RAY DIFFRACTIONr_scangle_it6.0234.51235
X-RAY DIFFRACTIONr_rigid_bond_restr
X-RAY DIFFRACTIONr_sphericity_free
X-RAY DIFFRACTIONr_sphericity_bonded
LS refinement shellResolution: 2.21→2.27 Å / Total num. of bins used: 20
RfactorNum. reflection% reflection
Rfree0.3 62 -
Rwork0.24 1346 -
obs--65.16 %
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)
19.43364.8902-0.12137.66244.52026.43080.1911-0.28980.7348-0.0149-0.35930.6942-0.245-0.07560.16820.13060.051-0.02520.22-0.00510.1581-7.125-19.224-1.051
228.43680.5481.11824.6982.72163.16090.1555-0.09650.32760.0464-0.1134-0.0094-0.0872-0.0502-0.04220.2123-0.0009-0.01480.17930.01880.179311.194-9.3850.627
33.41611.59712.7871.00761.48682.8178-0.116-0.5636-0.0751-0.12260.0145-0.17450.0238-0.06630.10160.18510.04490.04950.45090.0210.286712.045-16.4541.253
415.62948.9221-1.05266.4143-1.2840.64780.2021-0.60490.54050.4555-0.07260.14-0.2046-0.0008-0.12950.14460.0274-0.02370.2402-0.06340.2234-5.569-23.3992.577
59.82312.6365-4.73650.8735-1.36096.5914-0.1706-0.0144-0.3509-0.203-0.01810.02380.3479-0.4010.18870.1958-0.0115-0.04320.2371-0.04250.1806-3.733-28.889-5.246
65.37892.7204-4.13651.978-3.69459.65530.02750.72650.2082-0.17390.40240.1655-0.1491-0.4508-0.42980.2393-0.0325-0.0140.2277-0.00420.13346.631-17.753-10.159
75.73541.96320.17628.9761-6.386817.3246-0.09780.37590.216-0.17180.24420.0714-0.3823-0.3469-0.14640.1081-0.00430.01820.2012-0.03220.1327.981-22.28-11.472
813.54680.92324.42833.250.43156.7778-0.0726-0.3226-0.96920.19850.09370.0380.6287-0.2467-0.0210.18410.0002-0.01280.1807-0.03090.19786.229-30.557-7.085
96.24534.24686.99063.82364.62918.2661-0.19270.3321-0.4761-0.7880.4908-0.831-0.12650.7496-0.29810.4739-0.03170.30120.4522-0.0720.428616.399-25.444-10.563
106.41743.1293-3.59695.9865-3.09259.08110.14030.2696-0.21570.08520.0518-0.276-0.16010.1108-0.1920.05440.0222-0.0150.2102-0.02080.155114.401-23.592-2.38
1117.13016.7096-4.45054.97390.21233.21480.2457-0.6353-0.43480.5302-0.1573-0.20560.2098-0.0493-0.08840.1750.03730.01840.28030.06210.1971-0.325-29.4972.601
1214.38974.6962-0.4165.8912-0.04070.92740.1732-0.130.18410.1648-0.10620.0871-0.1130.063-0.0670.14820.0121-0.00490.1612-0.00010.13767.758-22.358-0.211
132.38490.11611.28117.8791-4.052111.12360.00020.31330.15580.074-0.1831-0.4267-0.11690.34820.18280.1715-0.02660.02620.2283-0.02550.213819.063-12.544-5.345
1416.35168.0748-1.52026.8208-0.59292.00710.03780.25820.607-0.1663-0.0220.137-0.2840.0798-0.01570.1956-0.0042-0.01150.22460.01310.13747.376-12.988-8.04
155.6441-1.2615-1.55917.4986-1.90797.66360.0560.7212-0.3787-0.5694-0.02870.2125-0.1848-0.6483-0.02740.0983-0.0086-0.04060.2554-0.02140.0993-7.036-24.896-9.286
165.3741.20423.89081.1911.36535.9692-0.16740.24370.491-0.3916-0.08660.3361-0.3955-0.23110.2540.1690.0296-0.04350.3593-0.02940.2258-4.997-17.512-8.298
176.21710.47510.11482.8325-0.58871.68230.0248-0.04060.99050.079-0.05270.1197-0.48320.10290.02790.1478-0.04080.02510.2398-0.01230.303914.825-5.509-2.161
189.148-2.60552.6629.75942.53054.94960.189-0.0196-0.68230.006-0.22620.77120.18150.09130.03720.1161-0.05970.0140.2677-0.00040.134-28.461-36.5977.603
1923.447-1.2238-4.96855.20623.60925.17220.19470.34480.031-0.2417-0.23990.1071-0.079-0.15710.04510.1867-0.0042-0.01510.170.00790.1761-12.118-46.2345.466
2016.2296-5.5363-1.98044.28321.30621.0535-0.0751-0.20770.04450.2560.1456-0.25210.06970.1165-0.07040.158-0.0134-0.01240.1844-0.01740.1598-7.688-40.8196.085
2124.2577-2.1630.20179.4981-0.37030.51930.26580.5853-0.5167-0.5486-0.09840.20420.20570.021-0.16740.1654-0.0316-0.00910.1994-0.01150.1607-26.52-33.3793.503
229.382-2.32727.44021.2334-2.35217.0136-0.2319-0.16110.41940.30770.0642-0.0677-0.3564-0.19790.16770.111-0.0103-0.02180.2862-0.05830.149-25.72-27.0211.04
235.8372-3.0653.02231.9073-2.54529.4711-0.1475-0.6373-0.1880.16750.2356-0.00560.2639-0.4916-0.08810.186-0.0387-0.03740.22920.02230.1542-14.701-38.06416.776
244.3625-1.80.33196.3652-3.65615.4236-0.0648-0.3213-0.14630.1550.22020.0390.4489-0.3368-0.15540.125-0.0044-0.02720.2124-0.02890.1552-13.365-33.52218.125
2519.5199-0.0592-4.44963.97740.13834.98130.03330.28930.8185-0.19710.01370.0948-0.7036-0.1247-0.04710.1919-0.0109-0.00660.1748-0.03610.1794-15.202-25.25713.632
264.8953-4.8749-2.44486.05855.35811.4542-0.2194-0.78520.64710.36720.7597-0.56370.02911.0543-0.54030.1352-0.0774-0.00470.3574-0.10140.2906-4.948-30.54317.141
274.5995-2.03844.56557.3449-2.90535.441-0.1218-0.15160.41520.16960.055-0.5866-0.08310.14050.06680.0567-0.014-0.02990.2832-0.0880.2632-6.973-32.2239.017
285.1727-1.73494.30111.3812-1.87633.9717-0.11260.48190.2412-0.14850.08540.0276-0.09310.19020.02730.12840.0010.01290.27240.00340.1935-21.382-27.133.857
2912.303-4.8082-0.97663.39411.06671.75590.0003-0.0467-0.2238-0.06860.0237-0.160.10720.1651-0.02410.1454-0.0212-0.00380.1597-0.0010.1547-10.66-34.5517.832
309.23743.32241.807611.3342-2.72458.9536-0.0752-0.2971-0.20890.21620.1616-0.4056-0.01280.3344-0.08650.16230.0246-0.04580.2285-0.01660.2215-2.9-44.10713.094
3110.6368-8.3369-0.57618.11860.90450.2399-0.1423-0.0549-0.46630.28080.13970.25610.12840.13360.00260.17810.0086-0.0090.2514-0.01340.1281-18.82-38.93314.829
325.6217-0.88392.21678.6405-5.97657.1010.0952-1.1403-0.27490.16960.14130.7675-0.0912-0.8171-0.23650.097-0.05330.01080.3517-0.00670.1247-30.78-33.75816.512
3315.8271-4.19371.06683.43070.73442.5221-0.2503-0.689-0.70650.38660.24130.43650.1645-0.10750.00890.1579-0.0102-0.00880.19740.00120.1682-17.268-44.76712.26
349.88741.4404-8.47627.96892.27979.5805-0.13550.6004-0.38480.43280.059-0.76340.7348-0.09310.07650.26880.1757-0.03380.3788-0.02250.2623-2.967-51.8497.421
3527.01911.897-3.88165.3812-0.703220.4317-0.1663-0.9256-0.05790.3495-0.0729-0.5559-0.22770.99170.23920.2565-0.001-0.08060.3448-0.06830.222-8.959-24.05635.034
367.17110.1959-0.28525.15031.46255.18310.0416-0.6560.18440.2469-0.09290.39540.4054-0.480.05130.3513-0.01630.00350.542-0.08510.1118-28.409-27.19842.139
3715.50144.5823-7.82546.8923-1.86734.05930.22860.19920.29020.0472-0.08260.1838-0.0267-0.2293-0.1460.2453-0.0008-0.03010.3941-0.07880.1015-23.884-21.82535.977
385.02036.25970.705112.6203-3.16456.28490.2499-0.48210.1570.6737-0.1736-0.4558-0.62390.5937-0.07630.3451-0.0884-0.01320.51-0.23790.3497-7.162-17.53532.219
3912.80845.1327-0.79385.65091.22543.6145-0.03640.10280.7477-0.190.2528-0.2533-0.43040.6089-0.21630.2136-0.0184-0.01330.296-0.03980.2072-9.841-21.30323.365
407.66582.7399-4.01224.5979-2.82884.2698-0.11960.3299-0.64060.32490.0057-0.63690.4095-0.04960.11390.28260.0122-0.08530.4294-0.05070.2164-21.039-31.1929.339
413.57421.351-2.234516.65491.76686.28880.0281-0.1847-0.09870.4743-0.1848-0.19920.22250.02030.15680.1458-0.0074-0.02390.2484-0.02010.125-22.163-29.60424.81
4220.4737-3.7289-4.13561.98641.37444.8241-0.15650.08331.0439-0.17460.19290.0242-0.6380.1188-0.03630.2153-0.0013-0.00540.26230.00110.1781-19.899-21.44120.583
437.64457.99050.419810.7142.11152.008-0.38450.1987-0.0484-0.1392-0.01970.3605-0.1152-0.80560.40420.26370.1301-0.03770.5844-0.07110.1454-30.437-26.65922.5
4413.049.1704-0.75738.17921.10145.63520.00980.54260.59160.55480.09990.334-0.3672-0.8009-0.10970.35220.0345-0.02150.3009-0.05260.1397-28.339-20.9728.675
4516.19646.0517-0.91765.1164-2.12124.97880.1932-0.51921.07260.0704-0.247-0.2359-0.61080.0890.05380.259-0.0088-0.00550.2449-0.03870.2592-14.396-15.68128.143
469.03177.4493-4.25468.6377-0.44176.85790.15560.08640.39190.4887-0.18710.3007-0.058-0.84840.03150.30260.0504-0.04960.4951-0.08780.1531-29.117-23.25933.096
4717.3195-8.5632-4.87944.5022.54321.5166-0.04650.0889-1.02660.2604-0.26510.36390.2374-0.1620.31160.4237-0.1223-0.02290.41990.00320.2801-30.196-33.76436.898
4817.06780-2.86472.1857-09.2091-0.0307-0.6917-0.18250.3966-0.2915-0.22850.3380.32760.32230.2413-0.0024-0.04130.3135-0.0420.1406-17.809-30.87132.147
4910.59213.87114.41735.72170.93072.21860.01790.5773-0.08670.181-0.0027-0.66620.19170.5016-0.01520.24780.0721-0.05120.3489-0.03090.183-5.388-27.77924.27
508.1057-6.687-5.66819.00826.22264.7735-0.4389-0.5449-0.44840.8030.3785-0.29040.58750.13130.06040.27270.0301-0.07310.5644-0.04210.1654-10.548-30.3831.953
5120.67543.60310.70266.7916-2.23311.2453-0.2673-0.4654-0.74890.40880.17320.07470.1301-0.08370.09410.41410.01620.10910.3523-0.030.2248-26.274-31.46741.67
528.6708-0.63956.9612.69340.41896.20980.12730.8427-0.4309-0.38980.0678-0.04660.16510.6294-0.19510.2739-0.00490.08090.4685-0.06320.16245.035-30.249-32.933
539.60960.8417-3.53080.3297-1.21628.86650.18810.29790.23830.0004-0.15830.1617-0.1459-0.2874-0.02980.24780.0021-0.02850.377-0.10050.2266-11.043-30.147-33.745
5429.5782-1.73795.76290.56510.71974.3620.19490.5763-0.0996-0.1082-0.0224-0.14180.16980.066-0.17250.2837-0.02760.00810.3244-0.04390.18253.4-35.096-28.525
5521.3644-0.14868.40510.96634.22897.8430.04270.31540.1994-0.2909-0.217-0.7633-0.17380.62990.17440.27230.03230.01130.362-0.05770.32216.291-38.204-23.256
569.7403-1.35641.65471.11841.46335.30840.2708-0.3164-0.4425-0.27280.2747-0.06480.37470.1466-0.54540.3862-0.0897-0.05560.3879-0.05470.17886.499-30.693-19.253
576.6763-0.41310.82620.40440.14655.9024-0.07790.49170.1094-0.3225-0.2192-0.0132-0.3296-0.07830.29710.33040.0306-0.00790.4432-0.03040.0884-1.033-24.734-19.352
5816.12742.45816.92585.89852.42749.5768-0.1357-0.3706-0.88470.12180.2107-0.00840.58420.1447-0.07490.2043-0.0199-0.00170.25180.01220.16111.497-34.369-14.156
594.5881-3.92380.216810.8789-0.32330.4757-0.2483-0.2424-0.0479-0.0440.04310.59210.0037-0.52440.20520.19940.0004-0.01160.6177-0.15710.2144-9.014-29.108-16.066
609.4897-4.60113.56793.2589-0.58034.2778-0.1168-0.5851-0.3958-0.30780.28630.00430.2655-0.4685-0.16950.448-0.06470.10560.371-0.04740.1812-6.854-34.677-22.22
6120.5676-5.72924.80772.50130.83448.79430.2506-0.0598-1.21230.0805-0.06090.03890.7069-0.116-0.18970.28870.01430.00920.28840.00020.45078.188-41.262-20.772
6218.3837-7.45816.07186.3407-2.70034.83620.23750.9212-0.2841-0.3013-0.08880.18020.2231-0.0766-0.14880.2081-0.0230.0060.2852-0.04190.1328-0.269-35.389-24.769
638.7147-0.05220.862541.4762-6.53939.86240.34470.18360.188-0.1103-0.42821.01450.1298-0.27960.08360.23390.0294-0.00360.4281-0.10190.1802-12.208-25.928-29.448
6416.66411.74415.76965.4752-0.61436.2535-0.00530.41060.6981-0.3937-0.1030.1089-0.32020.07810.10820.26250.01920.0230.3205-0.04640.1086-0.668-23.582-27.994
657.8879-0.5538-4.05449.0382-1.34762.580.0148-0.43720.0549-0.09030.0491-0.85880.09790.3232-0.06390.15970.0142-0.02080.3838-0.07140.261215.132-27.966-17.999
665.1740.4827-1.21821.7091.03021.6565-0.26160.8530.3392-0.33220.38760.2761-0.36030.5719-0.12590.3328-0.16250.02620.7603-0.02570.16510.789-25.317-25.36
679.4784-5.88420.186810.25-4.19553.41670.00740.41420.5227-0.5807-0.11680.3548-0.1686-0.34710.10940.48110.0765-0.29570.4979-0.14980.3804-5.661-24.304-35.589
Refinement TLS group
IDRefine-IDRefine TLS-IDAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1A33 - 38
2X-RAY DIFFRACTION2A39 - 45
3X-RAY DIFFRACTION3A46 - 52
4X-RAY DIFFRACTION4A53 - 58
5X-RAY DIFFRACTION5A59 - 64
6X-RAY DIFFRACTION6A65 - 69
7X-RAY DIFFRACTION7A70 - 74
8X-RAY DIFFRACTION8A75 - 79
9X-RAY DIFFRACTION9A80 - 84
10X-RAY DIFFRACTION10A85 - 89
11X-RAY DIFFRACTION11A90 - 94
12X-RAY DIFFRACTION12A95 - 100
13X-RAY DIFFRACTION13A101 - 106
14X-RAY DIFFRACTION14A107 - 113
15X-RAY DIFFRACTION15A114 - 118
16X-RAY DIFFRACTION16A119 - 125
17X-RAY DIFFRACTION17A126 - 133
18X-RAY DIFFRACTION18B33 - 38
19X-RAY DIFFRACTION19B39 - 44
20X-RAY DIFFRACTION20B45 - 52
21X-RAY DIFFRACTION21B53 - 57
22X-RAY DIFFRACTION22B58 - 64
23X-RAY DIFFRACTION23B65 - 69
24X-RAY DIFFRACTION24B70 - 74
25X-RAY DIFFRACTION25B75 - 79
26X-RAY DIFFRACTION26B80 - 84
27X-RAY DIFFRACTION27B85 - 89
28X-RAY DIFFRACTION28B90 - 95
29X-RAY DIFFRACTION29B96 - 101
30X-RAY DIFFRACTION30B102 - 107
31X-RAY DIFFRACTION31B108 - 116
32X-RAY DIFFRACTION32B117 - 122
33X-RAY DIFFRACTION33B123 - 127
34X-RAY DIFFRACTION34B128 - 133
35X-RAY DIFFRACTION35C34 - 39
36X-RAY DIFFRACTION36C40 - 46
37X-RAY DIFFRACTION37C47 - 53
38X-RAY DIFFRACTION38C54 - 58
39X-RAY DIFFRACTION39C59 - 64
40X-RAY DIFFRACTION40C65 - 69
41X-RAY DIFFRACTION41C70 - 74
42X-RAY DIFFRACTION42C75 - 79
43X-RAY DIFFRACTION43C80 - 84
44X-RAY DIFFRACTION44C85 - 89
45X-RAY DIFFRACTION45C90 - 96
46X-RAY DIFFRACTION46C97 - 103
47X-RAY DIFFRACTION47C104 - 109
48X-RAY DIFFRACTION48C110 - 114
49X-RAY DIFFRACTION49C115 - 119
50X-RAY DIFFRACTION50C120 - 125
51X-RAY DIFFRACTION51C126 - 130
52X-RAY DIFFRACTION52D36 - 42
53X-RAY DIFFRACTION53D43 - 49
54X-RAY DIFFRACTION54D50 - 54
55X-RAY DIFFRACTION55D55 - 59
56X-RAY DIFFRACTION56D60 - 67
57X-RAY DIFFRACTION57D68 - 74
58X-RAY DIFFRACTION58D75 - 79
59X-RAY DIFFRACTION59D80 - 84
60X-RAY DIFFRACTION60D85 - 89
61X-RAY DIFFRACTION61D90 - 94
62X-RAY DIFFRACTION62D95 - 100
63X-RAY DIFFRACTION63D101 - 106
64X-RAY DIFFRACTION64D107 - 113
65X-RAY DIFFRACTION65D114 - 119
66X-RAY DIFFRACTION66D120 - 125
67X-RAY DIFFRACTION67D126 - 131

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