Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1972117da33da49182addb57c747c873",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 38.797,
"b": 56.494,
"c": 225.878,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.200],
"number_observations_unique": 25924,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 10.600
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
"refln_shells": [
{
"resolution_limits": [2.28,2.20],
"number_observations_unique": 2561,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.556
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 3.30
}
]
},
{
"resolution_limits": [2.37,2.28],
"number_observations_unique": 2507,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.489
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 3.40
}
]
},
{
"resolution_limits": [2.48,2.37],
"number_observations_unique": 2544,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.380
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 3.40
}
]
},
{
"resolution_limits": [2.61,2.48],
"number_observations_unique": 2551,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.296
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 3.40
}
]
},
{
"resolution_limits": [2.77,2.61],
"number_observations_unique": 2568,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.214
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 3.40
}
]
},
{
"resolution_limits": [2.99,2.77],
"number_observations_unique": 2595,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.147
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 3.40
}
]
},
{
"resolution_limits": [3.29,2.99],
"number_observations_unique": 2563,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 3.40
}
]
},
{
"resolution_limits": [3.76,3.29],
"number_observations_unique": 2608,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "Completeness",
"value": 99.70
},
{
"type": "Redundancy",
"value": 3.30
}
]
},
{
"resolution_limits": [4.74,3.76],
"number_observations_unique": 2631,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 3.30
}
]
},
{
"resolution_limits": [50.00,4.74],
"number_observations_unique": 2796,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "Completeness",
"value": 98.90
},
{
"type": "Redundancy",
"value": 3.20
}
]
}
]
}