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- PDB-9c7o: Crystal Structure of the Maize R ACT-like Domain -

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Basic information

Entry
Database: PDB / ID: 9c7o
TitleCrystal Structure of the Maize R ACT-like Domain
ComponentsAnthocyanin regulatory Lc protein
KeywordsLIPID BINDING PROTEIN / LBP / CRBPII
Function / homology
Function and homology information


regulation of biosynthetic process / regulation of primary metabolic process / protein dimerization activity / DNA binding / nucleus
Similarity search - Function
: / Plant bHLH transcription factor, ACT-like domain / Transcription factor MYC/MYB N-terminal / bHLH-MYC and R2R3-MYB transcription factors N-terminal / Helix-loop-helix DNA-binding domain / helix loop helix domain / Myc-type, basic helix-loop-helix (bHLH) domain / Myc-type, basic helix-loop-helix (bHLH) domain profile. / Helix-loop-helix DNA-binding domain superfamily
Similarity search - Domain/homology
Anthocyanin regulatory Lc protein
Similarity search - Component
Biological speciesZea mays (maize)
MethodX-RAY DIFFRACTION / SYNCHROTRON / SAD / Resolution: 2.292 Å
AuthorsSilwal, J. / Ghanbarpour, A. / Lee, Y.S. / Geiger, J.H. / Grotewold, E.
Funding support United States, 2items
OrganizationGrant numberCountry
National Science Foundation (NSF, United States)MCB-1822343 United States
National Science Foundation (NSF, United States)MCB-1513807 United States
CitationJournal: To Be Published
Title: Crystal Structure of Maize R ACT-like domain
Authors: Silwal, J. / Ghanbarpour, A. / Lee, Y.S. / Geiger, J.H. / Grotewold, E.
History
DepositionJun 10, 2024Deposition site: RCSB / Processing site: RCSB
Revision 1.0Oct 8, 2025Provider: repository / Type: Initial release

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: Anthocyanin regulatory Lc protein
B: Anthocyanin regulatory Lc protein


Theoretical massNumber of molelcules
Total (without water)18,7952
Polymers18,7952
Non-polymers00
Water30617
1


  • Idetical with deposited unit
  • defined by author&software
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Buried area1530 Å2
ΔGint-8 kcal/mol
Surface area8730 Å2
MethodPISA
Unit cell
Length a, b, c (Å)74.124, 74.124, 90.144
Angle α, β, γ (deg.)90.00, 90.00, 90.00
Int Tables number96
Space group name H-MP43212

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Components

#1: Protein Anthocyanin regulatory Lc protein


Mass: 9397.415 Da / Num. of mol.: 2
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Zea mays (maize) / Gene: LC / Production host: Escherichia coli (E. coli) / References: UniProt: P13526
#2: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 17 / Source method: isolated from a natural source / Formula: H2O
Has ligand of interestY
Has protein modificationY

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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: 3.34 Å3/Da / Density % sol: 63.22 %
Crystal growTemperature: 298 K / Method: vapor diffusion, hanging drop / Details: 0.2M Sodium Thiocyanate, 20%PEG 3350

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Data collection

DiffractionMean temperature: 100 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: APS / Beamline: 21-ID-D / Wavelength: 0.97849 Å
DetectorType: DECTRIS EIGER X 9M / Detector: PIXEL / Date: Jun 21, 2019
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.97849 Å / Relative weight: 1
ReflectionResolution: 2.29→40 Å / Num. obs: 11190 / % possible obs: 94.4 % / Redundancy: 18.7 % / Rmerge(I) obs: 0.133 / Rrim(I) all: 0.158 / Net I/σ(I): 3.9
Reflection shell

Diffraction-ID: 1

Resolution (Å)Redundancy (%)Rmerge(I) obsNum. unique obsCC1/2CC starRpim(I) allRrim(I) allΧ2% possible all
2.29-2.339.10.4253980.9840.9960.1230.4440.46668.9
2.33-2.379.60.4534180.9840.9960.1280.4720.42673.1
2.37-2.4210.60.4774570.9810.9950.1310.4960.480.5
2.42-2.4711.80.5674980.9680.9920.1470.5870.37885.4
2.47-2.5212.80.6285130.9360.9830.1610.650.40589.7
2.52-2.5814.60.725540.9450.9860.1750.7420.44195.7
2.58-2.6417.10.6385830.9740.9930.1470.6550.39899.1
2.64-2.7119.70.6145780.9830.9960.1360.630.391100
2.71-2.7921.50.5535690.9810.9950.120.5660.45100
2.79-2.8922.30.4415910.990.9970.0940.4510.498100
2.89-2.9921.10.3525940.9780.9940.0780.360.64399.8
2.99-3.1118.70.265760.9930.9980.0610.2670.74399.8
3.11-3.2523.70.2145950.9910.9980.0450.2190.71299.8
3.25-3.4224.60.1815810.9870.9970.0380.1851.1899.8
3.42-3.6323.60.1485950.9580.9890.0330.1522.29999.8
3.63-3.9123.20.1245980.9920.9980.0280.1282.699.8
3.91-4.3122.20.1065970.980.9950.0240.1092.48999.3
4.31-4.9319.90.0886120.99910.0230.0913.18999.8
4.93-6.2117.30.0976150.9970.9990.0240.13.10598.6
6.21-4019.90.0956680.9950.9990.0220.0986.62197.1

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Processing

Software
NameVersionClassification
PHENIX(1.14_3260: ???)refinement
HKL-2000data scaling
HKL-2000data reduction
PHASERphasing
PHENIXphasing
RefinementMethod to determine structure: SAD / Resolution: 2.292→23.341 Å / SU ML: 0.3 / Cross valid method: FREE R-VALUE / σ(F): 0 / Phase error: 28.83 / Stereochemistry target values: MLHL
RfactorNum. reflection% reflection
Rfree0.2602 1070 9.99 %
Rwork0.2086 --
obs0.2136 10716 90.88 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL
Refinement stepCycle: LAST / Resolution: 2.292→23.341 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms1212 0 0 17 1229
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.011254
X-RAY DIFFRACTIONf_angle_d1.2051703
X-RAY DIFFRACTIONf_dihedral_angle_d16.242771
X-RAY DIFFRACTIONf_chiral_restr0.065209
X-RAY DIFFRACTIONf_plane_restr0.008210
LS refinement shell
Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRefine-ID% reflection obs (%)
2.2921-2.39630.3521910.2602837X-RAY DIFFRACTION65
2.3963-2.52250.30821150.24581008X-RAY DIFFRACTION78
2.5225-2.68030.30481290.25251192X-RAY DIFFRACTION92
2.6803-2.88690.30331430.22321279X-RAY DIFFRACTION98
2.8869-3.17680.26591440.22621298X-RAY DIFFRACTION99
3.1768-3.6350.2661470.19631320X-RAY DIFFRACTION99
3.635-4.57410.23791490.18151330X-RAY DIFFRACTION99
4.5741-23.3410.23331520.20851382X-RAY DIFFRACTION96
Refinement TLS params.Method: refined / Origin x: 53.1845 Å / Origin y: 30.9034 Å / Origin z: 36.9759 Å
111213212223313233
T0.3855 Å2-0.0011 Å20.0581 Å2-0.2568 Å2-0.0282 Å2--0.346 Å2
L1.4804 °2-0.5062 °20.2244 °2-5.0182 °2-0.3435 °2--1.2085 °2
S-0.0628 Å °-0.1455 Å °0.0679 Å °0.2456 Å °0.0863 Å °-0.0425 Å °0.0128 Å °-0.0253 Å °-0.0098 Å °
Refinement TLS groupSelection details: all

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